data_1k1v_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 1k1v _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 121.384 0.612 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -170.51 0.54 Allowed 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.711 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.525 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -80.5 -53.84 6.21 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.234 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.462 ' HB3' ' CZ ' ' A' ' 64' ' ' TYR . 14.2 mt-10 -58.59 -13.75 6.51 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 118.917 -1.113 . . . . 0.0 109.446 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.411 ' C ' ' N ' ' A' ' 30' ' ' VAL . 28.4 mm-40 -79.79 -49.03 12.6 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.523 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 28' ' ' GLU . 46.5 mt -41.61 -30.41 0.22 Allowed 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.117 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.412 ' H ' HG22 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -83.33 -61.86 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.338 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.68 -29.92 2.11 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.615 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 3.1 mtp -90.7 95.57 10.21 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.615 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 33.2 t -44.04 146.83 0.57 Allowed 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.712 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.465 HG21 HH21 ' A' ' 56' ' ' ARG . 2.0 t -41.37 -47.99 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.936 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -53.08 -41.82 65.27 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.902 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.524 ' OE1' ' N ' ' A' ' 36' ' ' GLU . 1.3 mp0 -73.73 -22.01 60.03 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 119.141 -1.024 . . . . 0.0 109.584 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.438 ' C ' ' N ' ' A' ' 39' ' ' GLN . 13.4 tp -79.31 -51.28 9.65 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.126 -1.03 . . . . 0.0 108.908 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.462 HD22 HG13 ' A' ' 34' ' ' VAL . 85.8 m-20 -53.26 -19.26 3.01 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.025 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.438 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -68.91 -42.76 76.42 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.52 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.458 ' CE1' HD11 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.3 -47.04 29.69 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.069 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.496 ' O ' ' N ' ' A' ' 43' ' ' GLY . 27.9 mt -42.66 -29.68 0.32 Allowed 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.087 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -45.96 95.62 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.577 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 133.46 -13.94 4.82 Favored Glycine 0 N--CA 1.484 1.838 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.458 HD11 ' CE1' ' A' ' 40' ' ' HIS . 16.4 mt -91.44 127.77 37.02 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.069 -1.052 . . . . 0.0 110.818 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.1 m -47.87 165.01 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.524 -0.871 . . . . 0.0 110.836 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 7.3 pttm -61.26 -20.52 62.95 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.001 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -85.79 -32.76 21.63 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.859 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.06 -13.35 59.82 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.079 -1.049 . . . . 0.0 109.984 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mt -81.78 -36.6 14.47 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.023 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.49 HD11 ' N ' ' A' ' 50' ' ' ILE . 1.5 mp -69.78 -33.75 57.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.69 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -64.62 -27.47 68.96 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 mp -93.53 -27.3 16.72 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.257 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -71.91 5.66 2.5 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.302 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -102.56 -64.51 1.06 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 119.831 -0.747 . . . . 0.0 111.204 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 58' ' ' THR . 38.2 mtt85 -50.86 -50.03 57.72 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.058 -1.057 . . . . 0.0 110.994 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.465 HH21 HG21 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -48.13 -33.24 7.99 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 118.971 -1.092 . . . . 0.0 110.542 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -79.3 -22.55 44.47 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.867 -1.133 . . . . 0.0 110.334 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.436 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.8 m -79.59 -42.28 25.33 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.258 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.458 ' CD1' ' O ' ' A' ' 26' ' ' ASP . 27.0 mt -58.84 -54.6 45.24 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.555 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -45.35 -22.18 0.12 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.264 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.412 ' N ' ' C ' ' A' ' 59' ' ' LEU . 27.2 t-20 -100.31 -45.9 5.44 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 119.637 -0.825 . . . . 0.0 111.906 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.505 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 11.0 ttt180 -53.37 176.53 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.23 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.505 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.8 -33.3 1.07 Allowed Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.685 -1.245 . . . . 0.0 110.318 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.462 ' CZ ' ' HB3' ' A' ' 27' ' ' GLU . 3.0 t80 . . . . . 0 C--N 1.306 -1.298 0 C-N-CA 119.316 -0.953 . . . . 0.0 110.319 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 121.417 0.627 . . . . 0.0 110.112 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.1 p -59.27 178.18 0.15 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.244 -0.982 . . . . 0.0 110.909 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -69.37 -33.72 73.47 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.09 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.613 ' CD ' ' N ' ' A' ' 27' ' ' GLU . 4.0 mp0 -63.5 -53.84 45.71 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.8 -1.16 . . . . 0.0 109.318 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.474 ' HB3' ' SD ' ' A' ' 32' ' ' MET . 21.9 mt-10 -45.51 -48.68 14.13 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.368 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.5 mt -44.91 -35.35 2.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.943 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.459 ' C ' ' N ' ' A' ' 32' ' ' MET . 2.3 t -99.87 -53.68 7.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.112 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.77 -26.16 0.23 Allowed 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.661 -1.216 . . . . 0.0 109.396 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.474 ' SD ' ' HB3' ' A' ' 28' ' ' GLU . 28.5 mtp -90.39 104.35 16.94 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.629 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 13.8 t -47.51 -96.16 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.24 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.419 ' N ' ' OG ' ' A' ' 33' ' ' SER . 47.8 t -138.04 -30.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.033 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -71.82 -52.77 15.84 Favored 'General case' 0 C--N 1.3 -1.578 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.403 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -66.2 -30.56 71.04 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.169 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.409 ' C ' ' N ' ' A' ' 39' ' ' GLN . 1.3 tt -73.99 -51.44 15.92 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -54.72 -16.8 2.78 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.8 OUTLIER -77.03 -39.22 50.97 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.337 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -38.97 34.94 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.92 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.52 ' O ' ' N ' ' A' ' 43' ' ' GLY . 16.2 mt -48.14 -30.4 4.53 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.024 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.49 ' HE ' ' HA ' ' A' ' 42' ' ' ARG . 15.0 mmm-85 -58.61 86.13 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.823 -1.151 . . . . 0.0 110.001 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 152.06 -13.11 0.73 Allowed Glycine 0 C--N 1.292 -1.893 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.6 mt -94.89 123.14 38.19 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.575 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 48' ' ' GLU . 94.0 p -66.86 155.61 37.91 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.338 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -43.82 -29.27 0.52 Allowed 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.67 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -83.56 -31.64 26.26 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.623 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 45' ' ' SER . 0.0 OUTLIER -81.71 -16.86 49.83 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.9 mt -81.63 -35.97 14.13 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.044 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -72.85 -50.06 35.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.657 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -65.89 -15.51 63.01 Favored 'General case' 0 C--N 1.296 -1.72 0 C-N-CA 119.291 -0.964 . . . . 0.0 110.297 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.573 ' CD1' ' C ' ' A' ' 52' ' ' LEU . 3.0 tm? -101.02 -51.97 3.4 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.188 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.452 ' N ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -56.5 -6.46 0.3 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.62 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.5 tt0 -72.02 -71.65 0.27 Allowed 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.46 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.3 -51.49 6.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.022 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.7 ttp85 -42.58 -36.82 1.48 Allowed 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.187 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.1 ttm-85 -72.52 -31.4 65.3 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.384 -0.926 . . . . 0.0 110.544 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.524 ' N ' ' O ' ' A' ' 55' ' ' ARG . 21.9 m -67.98 -33.26 74.31 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.767 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.6 mt -66.03 -49.75 66.61 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.122 -1.031 . . . . 0.0 110.416 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.3 mmtt -52.48 -15.67 0.72 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -93.33 -50.48 5.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.563 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -51.17 171.72 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.153 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.66 -29.88 0.83 Allowed Glycine 0 N--CA 1.492 2.419 0 C-N-CA 119.677 -1.249 . . . . 0.0 110.662 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--N 1.302 -1.475 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.736 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.3 0.572 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.452 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -83.64 176.06 9.27 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.287 -0.965 . . . . 0.0 110.458 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.33 -47.22 79.21 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.374 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -43.02 97.13 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 118.859 -1.136 . . . . 0.0 109.355 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HB2' ' N ' ' A' ' 25' ' ' THR . 12.7 mm-40 -55.11 -44.74 75.23 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.649 -0.821 . . . . 0.0 111.367 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 14.2 mt -47.53 -34.02 7.09 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.422 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' THR . 2.7 t -94.13 -56.35 5.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 119.555 -0.858 . . . . 0.0 111.828 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.96 -29.66 0.87 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.002 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 29' ' ' LEU . 12.8 ptm -92.42 120.74 33.22 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.266 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 78.1 p -63.87 -145.16 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.995 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.8 t -92.69 -42.69 13.44 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.966 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -51.6 -45.23 63.11 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.949 -1.101 . . . . 0.0 110.117 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -73.23 -28.18 62.02 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.947 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.436 HD23 HH22 ' A' ' 56' ' ' ARG . 9.2 tp -72.68 -43.7 62.76 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.628 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 -56.27 -18.04 9.36 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.01 -1.076 . . . . 0.0 109.958 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -26.72 43.36 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.388 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.4 ' O ' ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -96.7 -36.97 10.5 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.692 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 43' ' ' GLY . 12.1 mt -42.28 -36.82 1.33 Allowed 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.016 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -59.46 84.37 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 119.054 -1.058 . . . . 0.0 110.053 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 156.76 -14.48 0.34 Allowed Glycine 0 C--N 1.293 -1.812 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.1 mt -96.94 129.23 44.42 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.64 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 48' ' ' GLU . 2.4 t -73.35 157.72 36.42 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.233 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -44.33 -40.0 5.0 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.228 -0.989 . . . . 0.0 110.767 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.62 -14.06 57.18 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.634 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.513 ' N ' ' O ' ' A' ' 45' ' ' SER . 25.9 tp10 -90.46 -25.25 20.42 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.462 -0.895 . . . . 0.0 109.832 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 32.1 mt -78.42 -22.36 13.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.091 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.9 mt -71.74 -62.21 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.318 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.429 ' CG ' ' N ' ' A' ' 52' ' ' LEU . 2.8 pt20 -50.64 -31.85 17.33 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.464 ' C ' ' H ' ' A' ' 54' ' ' GLN . 2.1 tp -75.15 -39.4 60.43 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.613 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HD3' ' NH2' ' A' ' 56' ' ' ARG . 37.0 mmtt -62.08 -3.55 1.3 Allowed 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.482 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.464 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.7 tt0 -88.09 -75.09 0.43 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.957 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.457 ' HG2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -49.14 -45.82 44.24 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.466 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.457 ' H ' ' HG2' ' A' ' 55' ' ' ARG . 5.1 tmm_? -53.41 -38.87 63.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.951 -1.1 . . . . 0.0 109.59 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -74.64 -34.9 62.85 Favored 'General case' 0 C--N 1.304 -1.376 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.286 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -61.18 -34.51 75.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 119.026 -1.07 . . . . 0.0 110.155 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.8 mt -69.05 -34.27 74.9 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.354 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -70.73 -9.7 57.82 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.581 -0.848 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.73 -56.99 2.34 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.665 -0.814 . . . . 0.0 111.674 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 ttt-85 -52.72 176.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -40.89 -30.96 0.4 Allowed Glycine 0 N--CA 1.494 2.541 0 C-N-CA 119.752 -1.213 . . . . 0.0 110.408 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 C--N 1.303 -1.428 0 C-N-CA 119.339 -0.944 . . . . 0.0 110.358 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.491 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 121.091 0.472 . . . . 0.0 110.407 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.7 p -55.81 179.87 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.881 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -71.53 -32.32 68.02 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 118.984 -1.087 . . . . 0.0 110.311 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -62.43 -20.73 64.79 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.083 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -87.07 -41.71 13.62 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.119 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.5 mt -41.4 -34.84 0.58 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.28 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.439 ' CG2' HD12 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -85.4 -61.7 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.711 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.923 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -26.93 0.82 Allowed 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.001 -1.08 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.5 mtp -90.3 92.1 8.78 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.979 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 34' ' ' VAL . 74.6 p -46.99 162.78 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.404 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.405 ' C ' ' O ' ' A' ' 33' ' ' SER . 21.5 t -39.9 -57.61 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.152 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.64 30.23 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.432 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.4 ' HG2' ' HG ' ' A' ' 33' ' ' SER . 14.0 mm-40 -60.19 -39.36 86.26 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.172 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.4 -49.43 60.09 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.521 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.24 -14.22 2.66 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.545 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -84.17 -33.52 24.19 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.394 -0.923 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.537 ' C ' ' H ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -85.76 -36.59 20.04 Favored 'General case' 0 C--N 1.305 -1.35 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.873 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.645 ' C ' ' H ' ' A' ' 43' ' ' GLY . 32.8 mt -47.13 -12.14 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.209 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.537 ' H ' ' C ' ' A' ' 40' ' ' HIS . 10.7 mmm180 -70.86 31.81 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.512 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.645 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -152.49 4.31 0.4 Allowed Glycine 0 C--N 1.294 -1.791 0 N-CA-C 109.261 -1.535 . . . . 0.0 109.261 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.2 mt -106.04 165.64 11.07 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.46 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.448 ' O ' ' N ' ' A' ' 49' ' ' ILE . 1.2 m -96.36 156.32 16.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.749 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -42.91 -46.04 5.21 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.124 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -71.13 -36.58 72.17 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -79.91 -11.34 59.81 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.093 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.448 ' N ' ' O ' ' A' ' 45' ' ' SER . 45.6 mt -90.49 -40.95 13.18 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.693 -0.803 . . . . 0.0 110.675 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -58.13 -56.93 12.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.124 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -51.05 -29.06 11.75 Favored 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.776 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.63 -35.25 45.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.937 -1.105 . . . . 0.0 111.343 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.4 mttt -59.3 -21.67 60.05 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.406 -0.918 . . . . 0.0 111.526 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.477 ' O ' ' N ' ' A' ' 57' ' ' ARG . 8.7 tt0 -98.88 -69.8 0.75 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.524 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.2 OUTLIER -40.33 -50.9 2.81 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.214 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.425 ' NH1' ' HD2' ' A' ' 57' ' ' ARG . 1.0 OUTLIER -46.95 -36.03 7.2 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 118.79 -1.164 . . . . 0.0 109.927 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 54' ' ' GLN . 5.4 tpt85 -77.01 -18.94 57.85 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.474 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.522 ' N ' ' O ' ' A' ' 55' ' ' ARG . 3.3 m -82.64 -34.62 27.46 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.02 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.439 HD12 ' CG2' ' A' ' 30' ' ' VAL . 15.3 mt -51.95 -51.81 54.54 Favored 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.895 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -49.14 -17.97 0.28 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.992 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 59' ' ' LEU . 66.1 m-20 -106.14 -35.24 7.28 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.007 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.503 ' NE ' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -62.45 -169.64 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.505 -0.878 . . . . 0.0 110.948 -179.969 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.503 ' H ' ' NE ' ' A' ' 62' ' ' ARG . . . -43.86 -56.36 5.14 Favored Glycine 0 N--CA 1.491 2.326 0 C-N-CA 119.504 -1.331 . . . . 0.0 110.696 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.486 1.347 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.192 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.454 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.391 0.615 . . . . 0.0 109.98 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.7 p -63.64 -178.4 0.29 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.735 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -75.26 -36.13 61.3 Favored 'General case' 0 C--N 1.3 -1.587 0 C-N-CA 119.306 -0.957 . . . . 0.0 110.286 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.625 ' OE1' ' CE1' ' A' ' 64' ' ' TYR . 18.2 mm-40 -68.91 -6.87 29.99 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.935 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -90.34 -49.98 6.22 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 62.5 mt -43.05 -37.73 2.05 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.451 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.7 t -76.96 -55.33 11.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.177 -1.009 . . . . 0.0 110.525 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -48.52 -29.35 4.1 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.467 -1.293 . . . . 0.0 108.648 179.805 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 58.3 mtp -90.84 104.22 16.83 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.159 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m -46.65 -92.78 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.827 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.89 -30.4 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 C-N-CA 119.586 -0.846 . . . . 0.0 109.846 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -74.8 -36.68 62.48 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.308 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.92 -26.43 48.99 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.473 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.1 tp -79.2 -46.23 18.29 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.525 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -68.05 -8.54 38.66 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.664 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.532 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 1.8 mm-40 -80.83 -24.9 38.12 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.033 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.454 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -104.87 -30.11 10.07 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.369 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.653 ' C ' ' H ' ' A' ' 43' ' ' GLY . 17.2 mt -57.93 -37.33 73.88 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.585 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -55.51 -0.27 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.813 -1.155 . . . . 0.0 110.936 -179.86 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.653 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -100.37 -9.87 46.29 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.0 mt -98.5 178.11 5.13 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.647 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.612 ' OG ' ' N ' ' A' ' 46' ' ' LYS . 28.7 t -79.51 -170.08 2.18 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.319 -0.952 . . . . 0.0 110.249 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.612 ' N ' ' OG ' ' A' ' 45' ' ' SER . 8.7 mtpp -79.78 -38.62 32.72 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.768 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.15 -25.17 51.69 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.462 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -78.41 -17.2 56.73 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.369 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 35.4 mt -86.12 -27.67 6.15 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.345 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.896 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.4 mt -66.16 -63.86 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.251 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -57.43 -27.92 62.83 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.54 -0.864 . . . . 0.0 111.494 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.454 ' N ' HD23 ' A' ' 52' ' ' LEU . 3.4 mm? -76.89 -28.65 55.43 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.925 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -37.68 68.59 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.587 -0.845 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -79.04 -38.4 36.64 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.196 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 58' ' ' THR . 7.1 ttt180 -56.17 -55.68 30.13 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.484 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.491 ' CD ' ' C ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -46.25 -41.34 12.82 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 118.946 -1.102 . . . . 0.0 109.526 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -66.63 -34.27 77.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.555 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.411 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.1 m -65.96 -38.33 88.29 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.544 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.41 ' C ' ' N ' ' A' ' 61' ' ' ASN . 17.2 mt -58.14 -48.93 78.74 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.067 -1.053 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.83 -23.61 0.29 Allowed 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.254 -0.978 . . . . 0.0 110.56 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 59' ' ' LEU . 2.1 t30 -98.87 -37.33 9.47 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.167 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.7 ttt-85 -59.51 178.61 0.14 Allowed 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.976 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.89 -45.46 5.9 Favored Glycine 0 N--CA 1.493 2.439 0 C-N-CA 119.624 -1.274 . . . . 0.0 110.258 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.625 ' CE1' ' OE1' ' A' ' 27' ' ' GLU . 5.1 t80 . . . . . 0 C--N 1.302 -1.492 0 C-N-CA 119.581 -0.848 . . . . 0.0 110.451 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.438 HD21 ' CD2' ' A' ' 40' ' ' HIS . 11.0 tp . . . . . 0 C--O 1.215 -0.711 0 CA-C-O 121.356 0.598 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.2 p -62.94 177.99 0.51 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 118.557 -1.257 . . . . 0.0 110.066 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.22 -28.06 59.8 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.359 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.63 -18.09 63.57 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.94 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -90.2 -42.55 10.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.394 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.42 ' CD2' HD13 ' A' ' 37' ' ' LEU . 14.4 mt -42.62 -35.75 1.19 Allowed 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.065 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.432 ' C ' ' N ' ' A' ' 32' ' ' MET . 1.6 t -82.06 -61.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.464 -0.894 . . . . 0.0 110.873 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.33 -24.3 0.47 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 118.863 -1.135 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.432 ' N ' ' C ' ' A' ' 30' ' ' VAL . 15.0 mtp -90.31 91.41 8.48 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.827 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 40.4 t -47.64 164.62 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.95 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.3 t -41.63 -56.57 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.095 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.4 ' HE ' ' HB2' ' A' ' 35' ' ' ARG . 11.0 tpp180 -52.63 -46.79 67.24 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.474 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.97 -43.37 98.97 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.146 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.42 HD13 ' CD2' ' A' ' 29' ' ' LEU . 19.5 tp -66.78 -45.7 77.62 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.869 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -57.86 -22.84 50.1 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.193 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.3 -24.93 59.3 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.756 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.438 ' CD2' HD21 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -98.07 -19.43 17.97 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.589 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.682 ' C ' ' H ' ' A' ' 43' ' ' GLY . 30.9 mt -76.4 -23.25 54.03 Favored 'General case' 0 C--N 1.304 -1.412 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.702 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 -69.28 27.96 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.701 -1.2 . . . . 0.0 110.66 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.682 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -139.44 -3.08 1.66 Allowed Glycine 0 N--CA 1.479 1.555 0 N-CA-C 109.028 -1.629 . . . . 0.0 109.028 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.4 mt -103.03 178.75 4.47 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.991 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.4 t -90.88 153.4 20.23 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.658 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -48.73 -42.48 35.4 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.043 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.505 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 1.8 mp0 -75.85 -23.93 55.73 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.231 -0.988 . . . . 0.0 110.773 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -82.12 -19.37 40.22 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.017 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -76.06 -32.16 22.71 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 C-N-CA 119.536 -0.865 . . . . 0.0 109.696 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.461 ' N ' HD11 ' A' ' 50' ' ' ILE . 1.5 mp -70.3 -32.61 51.12 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 C-N-CA 119.659 -0.816 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -65.99 -39.04 89.98 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.043 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 93.1 mt -86.33 -34.12 20.38 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.418 -0.913 . . . . 0.0 111.253 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -62.7 -12.99 27.15 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.237 -0.985 . . . . 0.0 110.791 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.04 -68.64 0.79 Allowed 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -48.47 -47.96 38.12 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.03 -1.068 . . . . 0.0 110.386 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -47.75 -42.91 26.57 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.073 -1.051 . . . . 0.0 109.959 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -68.9 -29.53 67.82 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.284 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -66.05 -37.69 86.48 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.3 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.4 mt -66.27 -53.21 39.52 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.178 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -57.6 -14.01 4.7 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.446 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -90.13 -62.02 1.56 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.423 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 63' ' ' GLY . 10.1 ptp180 -52.4 176.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.729 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -37.8 -42.7 1.11 Allowed Glycine 0 N--CA 1.498 2.793 0 C-N-CA 120.182 -1.009 . . . . 0.0 111.009 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.304 -1.41 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.49 179.974 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.4 tp . . . . . 0 CA--C 1.491 -1.299 0 CA-C-O 121.69 0.757 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -52.21 171.31 0.05 Allowed 'General case' 0 C--N 1.283 -2.291 0 C-N-CA 118.714 -1.194 . . . . 0.0 110.637 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.18 -28.37 64.19 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.338 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -71.24 -11.55 60.98 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.73 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -89.37 -45.21 9.64 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.21 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.1 mt -41.27 -31.55 0.23 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.615 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.4 t -85.75 -61.27 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.169 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -27.75 1.16 Allowed 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 118.934 -1.106 . . . . 0.0 110.247 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.9 mtp -90.24 91.9 8.7 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.0 t -51.04 171.2 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.829 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 77.3 t -46.09 -64.41 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 119.434 -0.907 . . . . 0.0 110.98 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 27.2 ptt-85 -47.38 -42.16 21.26 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.933 -1.107 . . . . 0.0 110.207 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' A' ' 35' ' ' ARG . 9.3 tt0 -68.94 -40.01 79.21 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.875 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 tp -67.52 -43.1 81.64 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.446 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -49.49 -34.68 17.64 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.015 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -41.17 92.67 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.27 -0.972 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.03 -38.02 57.7 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.357 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.523 ' O ' ' N ' ' A' ' 43' ' ' GLY . 41.6 mt -62.8 -19.31 63.93 Favored 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.643 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.85 77.89 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.149 -1.02 . . . . 0.0 110.124 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 153.84 -10.11 0.48 Allowed Glycine 0 C--N 1.295 -1.708 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.2 mt -92.71 151.25 20.17 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.692 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -75.37 152.3 38.09 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.779 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.442 ' HG3' ' N ' ' A' ' 47' ' ' GLU . 14.6 ptpt -45.17 -41.88 8.58 Favored 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.909 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.442 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 11.5 mt-10 -75.9 -27.68 57.79 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.572 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -80.19 -19.09 47.88 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.092 -1.043 . . . . 0.0 109.91 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.6 mt -78.99 -33.17 15.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 C-N-CA 119.416 -0.914 . . . . 0.0 109.608 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.4 mt -62.35 -62.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.419 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -48.03 -30.32 4.28 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.63 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.36 -34.04 75.37 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.471 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.48 ' HD3' ' HE ' ' A' ' 56' ' ' ARG . 24.6 mmtp -77.95 -5.2 50.43 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.728 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.456 ' O ' ' N ' ' A' ' 57' ' ' ARG . 7.2 tt0 -76.03 -85.18 0.05 Allowed 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.348 -0.941 . . . . 0.0 111.031 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.463 ' HG2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -45.35 -37.77 5.23 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 119.062 -1.055 . . . . 0.0 110.497 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.48 ' HE ' ' HD3' ' A' ' 53' ' ' LYS . 42.5 ttp85 -57.87 -31.37 66.63 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.113 -1.035 . . . . 0.0 109.719 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' GLN . 22.1 ttp180 -75.91 -30.75 58.88 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.265 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -66.85 -37.73 85.02 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.527 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.6 mt -67.55 -51.87 45.56 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.578 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.459 ' HZ2' ' HB3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.31 -14.85 5.0 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.221 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -88.41 -63.62 1.27 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.426 -0.91 . . . . 0.0 112.351 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 64' ' ' TYR . 17.7 ptm180 -48.81 169.5 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.508 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -38.16 -31.24 0.1 OUTLIER Glycine 0 N--CA 1.497 2.75 0 C-N-CA 120.035 -1.079 . . . . 0.0 110.542 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.445 ' N ' ' O ' ' A' ' 62' ' ' ARG . 3.9 t80 . . . . . 0 C--N 1.302 -1.464 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.067 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 C--O 1.217 -0.658 0 CA-C-O 121.919 0.866 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.476 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -70.95 174.96 5.52 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.104 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -52.09 -50.33 61.82 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.161 -1.015 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.527 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 1.7 mp0 -65.69 -29.31 69.84 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.283 -0.967 . . . . 0.0 111.1 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.476 ' HB2' ' N ' ' A' ' 25' ' ' THR . 8.8 mt-10 -72.42 -35.85 68.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.203 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.0 mt -59.76 -44.58 93.79 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.422 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.477 ' C ' ' N ' ' A' ' 32' ' ' MET . 3.0 t -71.44 -49.66 45.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.83 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.285 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.46 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.47 -28.57 0.37 Allowed 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.076 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.477 ' N ' ' C ' ' A' ' 30' ' ' VAL . 30.4 mtp -92.4 113.13 25.32 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.577 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.7 t -49.23 -95.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.744 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 6.6 t -147.06 -27.49 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.834 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.2 ptt-85 -74.03 -40.27 62.98 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.422 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -71.98 -31.29 66.11 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.279 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 20.4 tp -72.53 -51.64 19.07 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.466 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.03 -14.44 23.34 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.68 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.58 -39.1 53.67 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.861 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.87 -26.46 22.76 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.793 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.532 ' O ' ' N ' ' A' ' 43' ' ' GLY . 15.8 mt -58.16 -32.88 68.62 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.334 -0.946 . . . . 0.0 111.059 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -64.2 76.68 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 118.841 -1.143 . . . . 0.0 110.053 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 167.07 -13.89 0.07 OUTLIER Glycine 0 C--N 1.294 -1.775 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.417 ' CD1' HD22 ' A' ' 52' ' ' LEU . 20.3 mt -87.86 170.92 10.76 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.442 ' H ' ' HB3' ' A' ' 48' ' ' GLU . 15.7 m -94.81 165.67 12.36 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.754 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -50.2 -56.83 9.44 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.22 -23.4 66.42 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 119.4 -0.92 . . . . 0.0 111.24 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.442 ' HB3' ' H ' ' A' ' 45' ' ' SER . 42.0 tt0 -84.96 -15.57 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.157 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.5 mt -89.94 -42.23 14.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.586 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mt -59.83 -49.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.012 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -54.4 -39.14 66.98 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.417 HD22 ' CD1' ' A' ' 44' ' ' LEU . 5.1 mp -73.52 -33.92 65.0 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.213 -0.995 . . . . 0.0 111.042 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.1 mttt -66.84 -5.4 12.18 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.43 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 55' ' ' ARG . 9.0 tp60 -96.89 -77.07 0.5 Allowed 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.767 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' N ' ' A' ' 58' ' ' THR . 1.2 mmp_? -42.4 -58.09 2.35 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.166 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -47.48 -38.3 13.47 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 118.782 -1.167 . . . . 0.0 109.888 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -76.7 -25.06 53.19 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.89 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' ARG . 37.0 m -77.38 -38.09 50.69 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.873 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.468 ' O ' ' N ' ' A' ' 61' ' ' ASN . 29.2 mt -59.17 -60.8 3.28 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.607 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.7 mtpp -43.38 -22.16 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.609 -0.837 . . . . 0.0 111.188 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 59' ' ' LEU . 25.0 t30 -93.56 -42.89 8.97 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.157 -1.017 . . . . 0.0 111.437 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -62.83 -160.9 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.308 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.22 96.36 Favored Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.623 -1.275 . . . . 0.0 110.903 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--N 1.305 -1.337 0 C-N-CA 119.133 -1.027 . . . . 0.0 110.859 -179.966 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.432 ' HG ' ' CE1' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.445 ' OG1' ' OE1' ' A' ' 28' ' ' GLU . 2.8 p -57.73 -175.03 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 118.796 -1.162 . . . . 0.0 110.771 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -69.9 -38.52 76.34 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.86 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 28' ' ' GLU . 6.0 pt-20 -61.35 -41.48 97.13 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.904 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.445 ' OE1' ' OG1' ' A' ' 25' ' ' THR . 0.3 OUTLIER -52.24 -49.85 63.19 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.578 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 mt -43.12 -41.5 3.68 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.65 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.66 -59.11 3.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.573 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.9 -28.56 9.89 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 118.877 -1.129 . . . . 0.0 109.435 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 34.3 mtp -91.0 96.32 10.56 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.549 -0.86 . . . . 0.0 111.078 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' N ' ' A' ' 37' ' ' LEU . 60.4 p -54.15 178.47 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.915 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 67.4 t -50.04 -61.05 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.346 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.9 ttp180 -51.01 -43.48 60.85 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.583 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -72.63 -30.97 64.78 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.208 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 33' ' ' SER . 56.2 tp -73.86 -43.65 57.94 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -65.69 -7.41 15.28 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.119 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.68 -12.83 38.38 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.762 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.432 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -98.1 -35.52 10.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.475 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.604 ' CD1' ' C ' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -77.94 14.21 1.18 Allowed 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 118.68 -1.208 . . . . 0.0 112.149 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.2 mtp85 -51.21 90.1 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.825 -1.15 . . . . 0.0 110.776 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 128.92 4.51 5.12 Favored Glycine 0 N--CA 1.484 1.861 0 C-N-CA 119.925 -1.131 . . . . 0.0 110.72 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 20.9 mt -85.15 147.18 26.74 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.126 -1.43 . . . . 0.0 110.975 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.422 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 14.8 t -80.31 175.41 10.68 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.345 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.575 ' CD ' ' H ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -60.26 -38.19 82.76 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.22 -0.992 . . . . 0.0 110.746 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -82.12 -18.0 44.47 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.502 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.422 ' HB2' ' H ' ' A' ' 45' ' ' SER . 2.4 mt-10 -87.62 -23.75 24.17 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.247 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 42.0 mt -80.65 -32.28 12.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.099 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.52 -58.72 5.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.401 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -52.83 -33.64 50.33 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.514 -0.874 . . . . 0.0 110.802 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.459 ' N ' HD23 ' A' ' 52' ' ' LEU . 3.0 mm? -79.22 -33.37 43.77 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.236 -0.985 . . . . 0.0 110.549 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -80.93 -14.64 57.8 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.369 -0.933 . . . . 0.0 110.621 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.31 -63.2 1.16 Allowed 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.449 ' O ' ' N ' ' A' ' 58' ' ' THR . 70.9 mtt180 -45.92 -50.96 14.03 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.316 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -44.48 -38.32 4.03 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.285 -0.966 . . . . 0.0 110.444 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -75.12 -31.62 61.17 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.103 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.449 ' N ' ' O ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -68.02 -38.54 82.68 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.217 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 25.4 mt -65.21 -43.94 89.9 Favored 'General case' 0 C--N 1.306 -1.314 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.78 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -59.62 -22.36 61.73 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -95.86 -48.02 5.9 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.526 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -57.07 -175.86 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.028 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -45.59 -46.33 12.59 Favored Glycine 0 N--CA 1.49 2.289 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.304 -1.376 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.367 -179.95 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.741 ' CD1' ' H ' ' A' ' 25' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.212 -0.886 0 CA-C-O 121.371 0.605 . . . . 0.0 110.701 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.741 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -175.81 162.0 2.6 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.634 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.562 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -71.54 -46.94 58.13 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.105 -1.038 . . . . 0.0 109.998 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -20.19 39.26 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.266 -0.974 . . . . 0.0 109.852 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' VAL . 2.4 mt-10 -77.7 -47.21 19.71 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.795 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 28' ' ' GLU . 24.1 mt -39.68 -29.77 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.64 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.447 ' N ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -89.37 -63.05 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.626 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.636 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.41 -28.86 1.48 Allowed 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.042 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 6.1 mtp -88.07 91.07 8.64 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.226 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -41.34 154.59 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.968 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -39.87 -38.29 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.054 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.426 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 34.5 ttp180 -62.45 -46.68 87.44 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.032 -1.067 . . . . 0.0 109.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.426 ' CD ' ' HE ' ' A' ' 35' ' ' ARG . 2.9 mp0 -67.67 -37.95 83.07 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.326 -0.949 . . . . 0.0 109.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.86 -46.75 77.32 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.654 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -57.24 -19.83 23.76 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.17 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.41 -35.34 35.33 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.531 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.61 -37.22 42.83 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.861 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.673 ' C ' ' H ' ' A' ' 43' ' ' GLY . 49.2 mt -54.73 -13.7 1.12 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.026 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -69.9 27.7 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.361 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.673 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -144.57 -3.16 0.73 Allowed Glycine 0 C--N 1.292 -1.896 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.1 mt -107.74 149.9 27.61 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.041 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.35 152.52 30.39 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.288 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -46.43 -28.16 1.29 Allowed 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.833 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -82.46 -38.86 23.36 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.635 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -77.16 -15.1 59.66 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.056 -1.058 . . . . 0.0 109.628 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 57.6 mt -80.45 -39.07 18.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 C-N-CA 119.544 -0.862 . . . . 0.0 109.697 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mt -62.9 -62.27 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.275 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.455 ' HG3' ' N ' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -45.77 -28.97 1.16 Allowed 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.875 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -78.56 -41.78 31.08 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.246 -0.982 . . . . 0.0 110.898 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.5 mttp -50.25 -20.34 1.02 Allowed 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.422 ' O ' ' N ' ' A' ' 57' ' ' ARG . 37.9 tt0 -74.22 -73.13 0.24 Allowed 'General case' 0 C--N 1.301 -1.514 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.785 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.486 ' O ' ' N ' ' A' ' 58' ' ' THR . 4.8 mmp_? -43.15 -51.64 5.87 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.591 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -45.71 -36.48 5.01 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.808 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 54' ' ' GLN . 13.0 ttt85 -71.17 -27.96 63.9 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.647 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.486 ' N ' ' O ' ' A' ' 55' ' ' ARG . 23.8 m -72.21 -42.63 65.56 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.414 ' CD1' ' O ' ' A' ' 26' ' ' ASP . 36.7 mt -60.91 -57.97 10.39 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 118.733 -1.187 . . . . 0.0 110.498 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.41 -13.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.426 -0.909 . . . . 0.0 111.23 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.413 ' N ' ' C ' ' A' ' 59' ' ' LEU . 6.1 t-20 -91.94 -62.2 1.47 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 119.338 -0.945 . . . . 0.0 112.133 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 64' ' ' TYR . 7.6 ptm180 -51.61 173.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.26 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -39.06 -30.45 0.12 Allowed Glycine 0 N--CA 1.498 2.775 0 C-N-CA 119.889 -1.148 . . . . 0.0 110.462 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.436 ' N ' ' O ' ' A' ' 62' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.302 -1.486 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.158 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.675 ' CD1' ' CD2' ' A' ' 40' ' ' HIS . 6.0 mt . . . . . 0 CA--C 1.501 -0.913 0 CA-C-O 121.146 0.498 . . . . 0.0 110.683 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.489 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -58.06 -174.03 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.143 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.621 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -59.84 -56.89 16.12 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.752 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.54 ' H ' ' CD ' ' A' ' 27' ' ' GLU . 6.6 mp0 -64.33 -22.57 67.0 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.51 ' O ' ' CG ' ' A' ' 32' ' ' MET . 10.3 mm-40 -83.54 -9.74 58.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.207 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.8 mt -87.33 -24.75 24.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.434 -0.907 . . . . 0.0 111.141 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.441 ' O ' ' C ' ' A' ' 31' ' ' THR . 6.5 t -101.95 -39.78 6.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.066 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.452 ' HG1' ' HA ' ' A' ' 28' ' ' GLU . 0.8 OUTLIER -45.53 -46.61 14.09 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.51 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -94.44 133.72 37.73 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.052 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 83.5 p -64.72 -150.63 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.963 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -84.12 -42.35 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 119.339 -0.945 . . . . 0.0 111.302 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -56.57 -43.53 80.1 Favored 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.207 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 36' ' ' GLU . 8.9 mp0 -70.0 -26.47 64.08 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.344 -0.943 . . . . 0.0 109.918 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.449 ' CD1' ' CD1' ' A' ' 24' ' ' LEU . 36.6 tp -76.12 -54.48 6.77 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.352 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.748 ' N ' HD21 ' A' ' 38' ' ' ASN . 0.7 OUTLIER -58.89 -11.26 3.1 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.395 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.41 ' H ' ' C ' ' A' ' 37' ' ' LEU . 1.7 tt0 -76.24 -38.86 55.77 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.85 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.675 ' CD2' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -90.55 -37.42 13.86 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.562 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 43' ' ' GLY . 18.0 mt -45.94 -34.68 4.09 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.519 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.6 mtp180 -49.94 91.31 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.071 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 143.92 -15.53 2.17 Favored Glycine 0 C--N 1.295 -1.74 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.9 mt -90.44 140.29 29.86 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 119.114 -1.035 . . . . 0.0 110.682 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.474 ' H ' ' HG ' ' A' ' 45' ' ' SER . 4.0 m -56.18 -178.24 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.565 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -77.25 -21.0 54.4 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.856 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -89.15 -29.47 19.31 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.921 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.39 -14.51 59.36 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.132 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.4 mt -83.9 -43.06 17.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.446 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.469 HD11 ' N ' ' A' ' 50' ' ' ILE . 1.5 mp -62.76 -56.97 14.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.666 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.893 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.427 ' HG3' ' N ' ' A' ' 52' ' ' LEU . 9.1 pt20 -51.36 -29.86 16.79 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.851 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.427 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 1.2 mp -81.11 -25.79 36.7 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.933 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.443 ' HZ1' HD22 ' A' ' 37' ' ' LEU . 49.3 mmtt -81.62 -9.17 59.73 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.016 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -81.33 -75.14 0.3 Allowed 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.032 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -44.59 -42.38 7.31 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.279 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -50.52 -41.44 53.72 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.16 -1.016 . . . . 0.0 109.748 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.457 ' HG2' HH11 ' A' ' 57' ' ' ARG . 57.7 mmt-85 -74.96 -31.59 61.5 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.278 -0.969 . . . . 0.0 110.063 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.0 m -67.16 -38.14 84.96 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.337 -0.945 . . . . 0.0 110.409 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 19.3 mt -67.71 -34.33 76.65 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.639 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.412 ' HZ2' ' HB3' ' A' ' 60' ' ' LYS . 10.6 mtpp -67.46 -15.17 63.52 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.54 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -97.04 -49.1 5.14 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.748 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.48 ' O ' ' N ' ' A' ' 64' ' ' TYR . 57.9 ttt-85 -51.38 169.44 0.05 Allowed 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.424 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.479 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.62 -23.45 0.11 Allowed Glycine 0 N--CA 1.493 2.456 0 C-N-CA 119.608 -1.282 . . . . 0.0 110.949 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.48 ' N ' ' O ' ' A' ' 62' ' ' ARG . 6.1 t80 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.104 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.2 tp . . . . . 0 C--O 1.216 -0.7 0 CA-C-O 122.179 0.99 . . . . 0.0 110.073 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.455 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -59.54 163.86 3.88 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.777 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.09 -41.66 26.79 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.64 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -70.74 -32.42 69.58 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.713 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 28' ' ' GLU . 1.6 mp0 -66.21 -35.35 80.2 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.414 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 mt -60.25 -29.25 68.66 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.693 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.432 ' O ' ' C ' ' A' ' 31' ' ' THR . 17.1 t -92.66 -42.78 13.5 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.167 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.844 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.432 ' C ' ' O ' ' A' ' 30' ' ' VAL . 22.4 p -46.05 -37.29 6.54 Favored 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.591 -1.244 . . . . 0.0 107.803 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.6 ptm -92.92 123.84 36.47 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.856 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -66.05 -177.47 0.5 Allowed 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.019 -1.072 . . . . 0.0 110.793 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.522 ' O ' ' N ' ' A' ' 37' ' ' LEU . 44.7 t -62.23 -55.17 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.672 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -47.31 -30.02 2.88 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 118.696 -1.202 . . . . 0.0 109.432 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -85.37 -26.49 26.45 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.301 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 34' ' ' VAL . 5.0 tp -74.63 -41.21 60.79 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.149 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -51.08 -37.21 44.34 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.953 -1.099 . . . . 0.0 109.484 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.21 -37.29 77.09 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.105 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.8 -45.57 16.73 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.543 ' O ' ' N ' ' A' ' 43' ' ' GLY . 30.5 mt -50.22 -29.11 8.75 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.486 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -52.1 88.77 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.339 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 139.7 -13.27 3.17 Favored Glycine 0 N--CA 1.481 1.678 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.2 mt -97.74 137.47 36.57 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.83 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.461 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 0.4 OUTLIER -89.34 173.25 8.48 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.584 -0.846 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.5 mmtt -45.99 -46.91 16.68 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.26 -31.78 70.55 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.981 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.461 ' HB2' ' H ' ' A' ' 45' ' ' SER . 23.9 mt-10 -83.42 -21.5 32.96 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.446 ' N ' ' O ' ' A' ' 45' ' ' SER . 2.3 mt -82.42 -34.74 12.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.004 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 22.8 mt -59.49 -57.09 13.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.583 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.414 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 4.2 mm100 -42.07 -31.21 0.34 Allowed 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.168 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.535 ' C ' ' H ' ' A' ' 54' ' ' GLN . 34.2 mt -88.26 -32.86 18.3 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -64.74 4.87 0.36 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.356 -0.938 . . . . 0.0 111.008 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.535 ' H ' ' C ' ' A' ' 52' ' ' LEU . 6.3 tt0 -99.21 -89.16 0.32 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.486 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 54' ' ' GLN . 12.4 tpt180 -43.65 -50.55 7.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.688 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.429 ' HE ' HD11 ' A' ' 37' ' ' LEU . 64.7 ttt-85 -48.98 -31.18 7.01 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.766 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 54' ' ' GLN . 0.2 OUTLIER -76.67 -32.15 57.75 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.644 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 m -69.59 -41.71 75.4 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.962 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 40.8 mt -70.72 -35.29 72.63 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.134 -1.026 . . . . 0.0 110.616 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -72.6 -13.22 61.33 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.583 -0.847 . . . . 0.0 111.517 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -91.55 -67.01 0.88 Allowed 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.16 -1.016 . . . . 0.0 112.155 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.48 ' HG3' ' H ' ' A' ' 64' ' ' TYR . 4.0 ptm180 -51.11 173.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.49 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -36.32 -35.73 0.12 Allowed Glycine 0 N--CA 1.5 2.947 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.289 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.48 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--N 1.301 -1.514 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.424 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.1 tp . . . . . 0 C--O 1.216 -0.691 0 CA-C-O 121.857 0.837 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.7 p -51.3 169.31 0.05 Allowed 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.34 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.89 -8.58 55.24 Favored 'General case' 0 C--N 1.299 -1.603 0 C-N-CA 118.897 -1.121 . . . . 0.0 110.5 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.412 ' O ' ' OG1' ' A' ' 31' ' ' THR . 18.3 mt-10 -90.17 -14.54 33.32 Favored 'General case' 0 C--N 1.295 -1.798 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.237 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.469 ' HA ' ' HG1' ' A' ' 31' ' ' THR . 33.6 mm-40 -90.92 -48.87 6.75 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 119.857 -0.737 . . . . 0.0 112.014 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' A' ' 28' ' ' GLU . 14.5 mt -39.66 -46.42 1.83 Allowed 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 119.819 -0.753 . . . . 0.0 111.536 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.416 ' C ' ' N ' ' A' ' 32' ' ' MET . 12.0 t -70.78 -57.64 7.28 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.233 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.469 ' HG1' ' HA ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -51.7 -20.22 1.98 Allowed 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 118.597 -1.241 . . . . 0.0 109.444 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.416 ' N ' ' C ' ' A' ' 30' ' ' VAL . 75.2 mtp -89.98 90.61 8.23 Favored 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.646 -0.821 . . . . 0.0 110.666 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 p -49.0 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.746 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 61.1 t -139.88 -26.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 C-N-CA 119.876 -0.73 . . . . 0.0 110.307 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.484 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -76.81 -41.29 44.96 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.781 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 4.4 tp10 -76.34 -29.96 57.44 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.431 -0.908 . . . . 0.0 109.514 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.1 tp -71.44 -43.52 66.54 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.878 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -58.47 -33.97 70.36 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.316 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -33.55 68.87 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.469 ' CE1' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -93.01 -35.48 13.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.516 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.617 ' C ' ' H ' ' A' ' 43' ' ' GLY . 40.4 mt -62.7 -15.58 53.4 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.135 -1.026 . . . . 0.0 110.991 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -70.34 39.76 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.958 -1.097 . . . . 0.0 110.261 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.617 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -158.72 -2.49 0.07 OUTLIER Glycine 0 C--N 1.293 -1.807 0 N-CA-C 108.793 -1.723 . . . . 0.0 108.793 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.469 HD13 ' CE1' ' A' ' 40' ' ' HIS . 22.3 mt -107.02 157.38 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 119.831 -0.748 . . . . 0.0 110.911 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.27 -176.04 4.97 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.803 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -66.66 -39.7 88.29 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.811 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.25 -36.5 69.07 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.801 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -74.08 -19.26 60.66 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.454 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mt -80.89 -38.93 17.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.722 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.8 mt -65.31 -50.56 72.6 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.328 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.946 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -54.12 -40.84 67.71 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.288 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mp -74.15 -37.49 64.02 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.293 -0.963 . . . . 0.0 110.246 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.56 -29.64 69.28 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.991 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -86.36 -45.16 11.46 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.384 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 -51.54 -61.57 2.16 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 119.256 -0.978 . . . . 0.0 109.936 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.503 ' CD ' ' C ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -47.28 -31.03 3.47 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 118.924 -1.11 . . . . 0.0 109.217 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.64 -37.96 48.88 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -60.47 -42.17 95.68 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.338 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' A' ' 61' ' ' ASN . 13.2 mt -54.83 -47.46 74.08 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.592 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -71.28 4.95 2.47 Favored 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.286 -0.966 . . . . 0.0 110.689 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 59' ' ' LEU . 1.6 t-20 -139.65 19.16 2.52 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.477 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.466 ' HG2' ' N ' ' A' ' 63' ' ' GLY . 35.3 ttt180 -137.1 -111.24 0.18 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.121 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.466 ' N ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.87 -75.47 0.76 Allowed Glycine 0 N--CA 1.491 2.309 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.926 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--N 1.304 -1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 111.225 -179.915 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.51 ' CD1' ' C ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.237 0.542 . . . . 0.0 109.905 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.11 149.51 27.97 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.203 -0.999 . . . . 0.0 110.559 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -48.11 -40.73 24.43 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.826 -1.149 . . . . 0.0 109.941 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.21 -24.69 63.35 Favored 'General case' 0 C--N 1.299 -1.624 0 C-N-CA 119.444 -0.903 . . . . 0.0 111.214 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.49 -40.46 29.66 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.259 -0.976 . . . . 0.0 111.061 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.9 mt -43.15 -34.27 1.06 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.593 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.6 t -85.88 -63.41 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.728 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.301 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.26 -28.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.145 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 9.0 mtp -88.23 91.59 8.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.223 -0.991 . . . . 0.0 110.507 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.506 ' O ' ' N ' ' A' ' 37' ' ' LEU . 2.6 p -55.39 -178.76 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.899 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.466 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 45.6 t -49.58 -52.68 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 111.2 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -54.72 -54.21 44.87 Favored 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.457 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -67.08 -30.3 70.29 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.415 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 33' ' ' SER . 9.7 tp -74.3 -39.89 62.62 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.173 -1.011 . . . . 0.0 110.109 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.474 ' N ' HD21 ' A' ' 38' ' ' ASN . 1.0 OUTLIER -58.98 -20.47 53.08 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.569 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -72.0 -31.14 65.94 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.53 -43.49 10.19 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.155 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 43' ' ' GLY . 19.0 mt -45.94 -47.52 16.46 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 119.539 -0.864 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 41' ' ' LEU . 4.5 mtp85 -41.78 94.52 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.571 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 141.16 -19.45 2.68 Favored Glycine 0 C--N 1.296 -1.646 0 N-CA-C 109.065 -1.614 . . . . 0.0 109.065 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.3 mt -84.82 147.51 26.78 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.621 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 48' ' ' GLU . 52.8 p -76.61 151.91 36.08 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.742 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.477 ' H ' ' HD2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -45.6 -35.71 4.21 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.268 -0.973 . . . . 0.0 110.603 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -77.7 -31.14 52.17 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.283 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 45' ' ' SER . 5.8 tt0 -77.94 -20.52 52.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.041 -1.064 . . . . 0.0 109.12 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.6 mm -72.83 -46.46 52.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.585 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 mt -58.81 -56.02 19.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -54.8 -37.97 66.73 Favored 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.41 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.26 -39.77 65.15 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.094 -1.042 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.7 mmmp? -62.39 -11.57 16.43 Favored 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.841 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -84.48 -56.53 3.57 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -55.52 -51.39 67.2 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.027 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -49.54 -38.12 29.55 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.995 -1.082 . . . . 0.0 109.697 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -33.55 67.18 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.983 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.464 ' O ' ' N ' ' A' ' 62' ' ' ARG . 96.0 m -64.09 -41.51 97.27 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.217 -0.993 . . . . 0.0 110.485 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.7 mt -54.49 -60.35 3.47 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.754 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp -47.57 -20.47 0.26 Allowed 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.444 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -106.25 -29.66 9.67 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.594 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.477 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 15.3 ttt180 -76.39 -147.54 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.032 -1.067 . . . . 0.0 111.483 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.477 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -57.73 -61.01 7.95 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.829 -1.176 . . . . 0.0 111.611 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--N 1.305 -1.344 0 C-N-CA 119.172 -1.011 . . . . 0.0 111.546 -179.868 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.467 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.5 OUTLIER . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.95 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.472 ' H ' ' HG3' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -80.38 -157.36 0.15 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.131 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -76.85 -53.73 7.52 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.972 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' CG2' ' A' ' 31' ' ' THR . 63.1 mt-10 -62.4 -24.28 67.31 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.206 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.472 ' HG3' ' H ' ' A' ' 25' ' ' THR . 37.1 mm-40 -63.87 -29.67 70.83 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.486 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.71 -45.72 74.29 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.696 0.76 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 41.4 t -78.42 -44.19 26.58 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.006 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.493 ' HG1' ' H ' ' A' ' 32' ' ' MET . 6.6 p -51.09 -35.39 34.85 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.493 ' H ' ' HG1' ' A' ' 31' ' ' THR . 10.3 mtm -92.52 123.58 35.92 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.549 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -162.86 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.247 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.99 -48.95 36.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.944 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -61.83 -31.25 71.47 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.604 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -77.42 -36.9 52.79 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.222 -0.991 . . . . 0.0 109.928 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 tp -74.49 -42.89 58.19 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.105 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -63.23 -14.36 48.36 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.944 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.09 -32.03 64.72 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.486 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.467 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -99.09 -27.13 13.98 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.226 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.539 ' O ' ' N ' ' A' ' 43' ' ' GLY . 17.5 mt -54.05 -33.53 57.67 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 119.218 -0.993 . . . . 0.0 111.765 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.489 ' CB ' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -63.61 78.26 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.386 -179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 165.76 -14.61 0.08 OUTLIER Glycine 0 C--N 1.296 -1.679 0 N-CA-C 109.134 -1.586 . . . . 0.0 109.134 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' CD1' HD21 ' A' ' 52' ' ' LEU . 22.4 mt -88.93 152.67 21.58 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 46' ' ' LYS . 11.1 t -74.19 155.19 38.62 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.206 -0.998 . . . . 0.0 110.315 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 45' ' ' SER . 1.0 OUTLIER -41.78 -43.24 2.87 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.504 -0.878 . . . . 0.0 111.202 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.69 -48.35 72.36 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.335 -0.946 . . . . 0.0 111.103 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.3 OUTLIER -62.52 -22.62 66.43 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.698 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mm -76.01 -43.15 38.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.749 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -69.55 -40.41 79.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 C-N-CA 118.986 -1.085 . . . . 0.0 109.339 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -57.56 -49.25 76.98 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.878 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.579 ' C ' ' H ' ' A' ' 54' ' ' GLN . 6.0 mp -69.97 -42.31 73.32 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.245 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.419 ' HD2' HH21 ' A' ' 56' ' ' ARG . 0.5 OUTLIER -61.17 5.54 0.06 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.018 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.579 ' H ' ' C ' ' A' ' 52' ' ' LEU . 30.2 tt0 -100.32 -76.34 0.56 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.291 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -42.71 -47.84 5.46 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.351 -0.94 . . . . 0.0 110.506 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.419 HH21 ' HD2' ' A' ' 53' ' ' LYS . 4.2 tmm_? -45.72 -36.22 4.84 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.206 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.632 ' CA ' ' HE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -74.82 -34.29 62.32 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.46 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.463 ' N ' ' HG3' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -77.74 -36.97 50.24 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.536 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -62.53 -21.12 65.3 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.315 -0.954 . . . . 0.0 111.409 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.443 ' HZ2' ' HA ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -90.41 0.97 57.06 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -121.49 -33.32 3.66 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.665 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.417 ' CG ' ' H ' ' A' ' 63' ' ' GLY . 10.8 ttp180 -65.94 -149.1 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.582 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.417 ' H ' ' CG ' ' A' ' 62' ' ' ARG . . . -69.21 -27.57 73.6 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.379 -1.391 . . . . 0.0 110.369 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.9 t80 . . . . . 0 C--N 1.308 -1.237 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.949 -179.946 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.475 HD23 ' CG ' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 121.312 0.577 . . . . 0.0 110.513 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.464 ' OG1' ' OE1' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -78.14 -174.48 3.67 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.437 179.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -52.43 51.05 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.355 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -56.07 -38.23 70.38 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.861 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.464 ' OE1' ' OG1' ' A' ' 25' ' ' THR . 0.7 OUTLIER -53.81 -46.88 71.24 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.922 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.7 mt -47.7 -39.67 18.13 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.573 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.428 ' C ' ' N ' ' A' ' 32' ' ' MET . 2.0 t -79.25 -58.95 3.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.915 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.76 -26.66 0.69 Allowed 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.09 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.428 ' N ' ' C ' ' A' ' 30' ' ' VAL . 62.7 mtp -91.05 97.85 11.41 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.923 -1.035 . . . . 0.0 109.993 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.3 m -48.94 -94.27 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 119.821 -0.752 . . . . 0.0 111.58 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.8 t -140.58 -31.59 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.593 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.5 ptt-85 -76.86 -23.76 52.65 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.897 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.34 -31.37 18.95 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.891 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tp -74.35 -39.59 62.69 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.272 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -61.67 -14.84 34.82 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.907 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -89.99 0.04 57.32 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.496 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.475 ' CG ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -113.38 -29.21 7.3 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.373 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.597 ' CD1' ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -84.01 3.36 34.73 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.469 -1.293 . . . . 0.0 112.789 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.525 ' N ' HD12 ' A' ' 41' ' ' LEU . 5.8 mtm180 -50.86 90.68 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.999 -1.08 . . . . 0.0 110.743 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 132.65 0.37 4.44 Favored Glycine 0 N--CA 1.482 1.76 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.8 mt -89.77 124.94 35.08 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 118.719 -1.193 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.6 m -60.36 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.326 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -73.88 -38.21 64.48 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.765 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.648 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 9.9 pm0 -83.15 -11.62 57.75 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.044 -1.062 . . . . 0.0 110.565 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.61 -21.68 21.6 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 119.388 -0.925 . . . . 0.0 110.176 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.86 -27.7 15.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 C-N-CA 119.424 -0.911 . . . . 0.0 109.627 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.479 ' N ' HD12 ' A' ' 50' ' ' ILE . 1.4 mp -70.29 -33.4 54.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.534 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -58.03 -43.09 86.58 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.563 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.484 ' N ' ' CD2' ' A' ' 52' ' ' LEU . 4.4 mm? -69.49 -35.79 75.89 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.681 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.418 ' HD3' HH21 ' A' ' 56' ' ' ARG . 15.0 mmtp -64.47 -0.52 1.36 Allowed 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.0 tp60 -86.46 -79.56 0.26 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.963 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -54.08 -38.0 64.83 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.039 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.474 ' NH1' ' HZ3' ' A' ' 60' ' ' LYS . 45.9 ttp85 -59.08 -31.27 68.74 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.013 -1.075 . . . . 0.0 109.724 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -79.43 -28.45 41.71 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.3 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.9 m -71.05 -34.72 71.5 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.294 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.3 mt -69.87 -48.61 58.1 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.163 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.474 ' HZ3' ' NH1' ' A' ' 56' ' ' ARG . 37.5 mttt -63.15 -10.6 15.63 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.644 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -89.4 -62.84 1.39 Allowed 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.395 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -53.36 178.21 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.608 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.409 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -40.09 -32.49 0.39 Allowed Glycine 0 N--CA 1.495 2.599 0 C-N-CA 119.844 -1.17 . . . . 0.0 110.62 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.6 t80 . . . . . 0 C--N 1.306 -1.292 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.429 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 121.108 0.48 . . . . 0.0 110.438 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -169.47 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.761 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.576 ' C ' ' H ' ' A' ' 28' ' ' GLU . 29.2 m-20 -73.3 -58.04 3.59 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.101 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -52.67 -8.56 0.09 Allowed 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.998 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.576 ' H ' ' C ' ' A' ' 26' ' ' ASP . 2.2 mt-10 -90.57 -32.63 16.21 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.641 -0.824 . . . . 0.0 111.424 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.455 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 92.4 mt -65.45 -23.97 67.06 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.73 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.461 ' O ' ' C ' ' A' ' 31' ' ' THR . 2.9 t -96.63 -59.92 2.93 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.006 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.264 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.463 ' CG2' ' N ' ' A' ' 32' ' ' MET . 14.6 t -41.43 -32.63 0.34 Allowed 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 118.989 -1.084 . . . . 0.0 108.688 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.515 ' SD ' ' O ' ' A' ' 28' ' ' GLU . 14.6 ptm -91.06 119.24 31.05 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.415 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.489 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 41.3 t -57.86 -174.85 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.471 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.489 ' N ' ' OG ' ' A' ' 33' ' ' SER . 48.7 t -68.97 -46.18 79.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.255 -0.978 . . . . 0.0 110.672 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -50.69 -46.39 58.78 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.174 -1.01 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.96 -25.36 63.6 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.179 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.451 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -78.94 -49.33 12.98 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.236 -0.986 . . . . 0.0 109.348 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.453 ' ND2' HG11 ' A' ' 34' ' ' VAL . 69.3 m-20 -59.6 -16.98 29.46 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.913 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -78.0 -33.46 51.25 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.361 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.461 ' O ' ' N ' ' A' ' 42' ' ' ARG . 0.7 OUTLIER -89.47 -45.16 9.63 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.364 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.461 ' C ' ' H ' ' A' ' 43' ' ' GLY . 42.4 mt -46.26 -18.9 0.06 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.703 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' N ' ' O ' ' A' ' 40' ' ' HIS . 1.4 ttp180 -56.35 -10.03 0.82 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.418 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.461 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -103.76 -1.78 46.17 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.8 mt -110.31 153.51 24.78 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 119.595 -0.842 . . . . 0.0 111.05 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.413 ' O ' ' N ' ' A' ' 48' ' ' GLU . 66.4 m -84.3 154.63 22.83 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.796 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -44.61 -36.33 3.01 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.792 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -80.27 -30.2 38.36 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.589 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 tp10 -81.9 -17.01 48.7 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.529 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 70.0 mt -82.06 -33.8 11.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.819 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.3 mt -61.21 -59.32 4.46 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.814 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.401 ' H ' ' HG3' ' A' ' 51' ' ' GLN . 15.1 mt-30 -51.36 -31.14 21.14 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.139 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.1 tp -83.66 -16.15 46.16 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.422 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -81.13 -27.35 35.56 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.122 -1.031 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -68.04 -64.25 0.9 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.192 -1.003 . . . . 0.0 110.392 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.55 -54.01 5.2 Favored 'General case' 0 C--N 1.307 -1.274 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.36 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 55' ' ' ARG . 10.9 ttt180 -42.5 -35.93 1.2 Allowed 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.95 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.2 tpt85 -72.55 -31.75 65.52 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.416 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 55' ' ' ARG . 17.6 m -67.5 -33.21 74.64 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.094 -1.042 . . . . 0.0 110.295 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 26.7 mt -68.18 -36.26 79.32 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.222 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -57.16 -16.84 8.79 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.42 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.468 ' C ' ' ND2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -87.91 -53.6 4.66 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.936 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.407 ' N ' HD21 ' A' ' 61' ' ' ASN . 0.4 OUTLIER -51.06 171.15 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.933 -179.979 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -44.03 -39.28 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 119.365 -1.398 . . . . 0.0 110.004 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.302 -1.457 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.187 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 121.728 0.775 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.97 161.35 0.07 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.193 -1.003 . . . . 0.0 110.958 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.15 -41.5 94.65 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.918 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.405 ' O ' ' OG1' ' A' ' 31' ' ' THR . 2.2 pt-20 -59.66 -18.66 43.75 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.818 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.18 -55.1 3.66 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.266 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 55.0 mt -37.78 -47.91 1.05 Allowed 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.983 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.421 ' H ' HG22 ' A' ' 30' ' ' VAL . 2.3 t -67.27 -57.25 10.49 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.974 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.184 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -51.62 -27.84 12.51 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 118.577 -1.249 . . . . 0.0 108.854 179.781 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 3.2 mtp -91.34 100.3 13.11 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.34 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.1 t -59.02 159.61 6.99 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.135 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' LEU . 41.2 t -45.87 -54.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.99 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -47.63 -41.87 23.02 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 118.643 -1.223 . . . . 0.0 109.997 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -76.82 -23.65 52.78 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.722 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 34' ' ' VAL . 14.6 tp -73.37 -46.06 51.24 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.885 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.506 ' N ' HD21 ' A' ' 38' ' ' ASN . 1.0 OUTLIER -49.9 -32.43 14.57 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.059 -1.057 . . . . 0.0 110.788 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.497 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -62.18 -18.54 61.28 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.801 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -108.57 -21.33 12.76 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.873 -0.731 . . . . 0.0 111.152 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.647 ' C ' ' H ' ' A' ' 43' ' ' GLY . 31.1 mt -70.13 -23.94 63.1 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.299 -0.96 . . . . 0.0 111.695 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -62.2 6.95 0.07 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 118.613 -1.235 . . . . 0.0 110.685 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.647 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -120.53 2.62 12.36 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.1 mt -110.98 155.89 22.04 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.951 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 m -77.58 -172.68 2.66 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.333 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.458 ' HG3' ' N ' ' A' ' 47' ' ' GLU . 24.4 pttt -68.19 -49.6 59.79 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.849 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.458 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 13.3 tp10 -69.7 -26.46 64.36 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.745 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -76.91 -19.99 56.75 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.489 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.4 mt -82.25 -43.22 19.22 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 119.214 -0.995 . . . . 0.0 109.936 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 63.3 mt -62.01 -53.48 47.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 C-N-CA 119.423 -0.911 . . . . 0.0 110.28 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -49.74 -45.48 49.43 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.076 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 tp -62.49 -35.58 79.82 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.517 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -65.43 -11.3 41.41 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.248 -0.981 . . . . 0.0 111.253 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -91.0 -45.64 8.6 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.199 -1.0 . . . . 0.0 111.324 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -64.05 -56.53 14.3 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 118.836 -1.146 . . . . 0.0 110.237 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 35.6 ttt-85 -50.37 -30.74 12.94 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.988 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -77.03 -29.93 55.49 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.417 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 m -69.83 -36.24 75.44 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.867 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.7 mt -66.53 -49.07 67.71 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.079 -1.048 . . . . 0.0 110.544 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mmmt -53.58 -18.61 3.02 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.612 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -96.13 -47.49 6.04 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.278 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.491 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -56.63 179.59 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.052 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.491 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -42.59 -43.12 4.92 Favored Glycine 0 N--CA 1.493 2.467 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.661 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--N 1.303 -1.421 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.91 -179.917 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.407 ' O ' ' C ' ' A' ' 25' ' ' THR . 5.1 tp . . . . . 0 C--O 1.216 -0.684 0 CA-C-O 122.071 0.939 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.407 ' C ' ' O ' ' A' ' 24' ' ' LEU . 1.2 p -41.97 152.81 0.07 Allowed 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.727 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.592 ' CG ' HH21 ' A' ' 55' ' ' ARG . 10.1 m-20 -52.28 -38.99 59.88 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 118.783 -1.167 . . . . 0.0 110.279 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -62.69 -18.24 62.08 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 119.467 -0.893 . . . . 0.0 111.738 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -90.76 -48.71 6.87 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.876 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.7 mt -39.98 -46.99 2.18 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.565 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.467 ' C ' ' N ' ' A' ' 32' ' ' MET . 4.2 t -69.33 -61.13 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.079 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.028 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.401 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -46.03 -22.73 0.23 Allowed 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 118.888 -1.125 . . . . 0.0 109.576 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.467 ' N ' ' C ' ' A' ' 30' ' ' VAL . 28.8 mtp -91.17 92.96 8.9 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.453 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 37' ' ' LEU . 1.6 t -53.01 176.25 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.889 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 t -53.69 -62.81 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.821 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.424 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 21.1 ptt180 -50.71 -33.18 21.82 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 118.942 -1.103 . . . . 0.0 110.024 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 21.8 mt-10 -78.59 -31.83 47.38 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.614 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.492 ' N ' ' O ' ' A' ' 33' ' ' SER . 15.9 tp -73.86 -45.26 52.14 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.62 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -54.02 -32.56 54.7 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 118.997 -1.081 . . . . 0.0 110.225 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -27.32 68.28 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.662 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.403 ' CE1' HD12 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -94.33 -30.04 14.72 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.653 -0.819 . . . . 0.0 110.757 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.557 ' O ' ' N ' ' A' ' 43' ' ' GLY . 44.3 mt -72.46 -32.98 66.7 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.2 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -52.82 88.59 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.112 -1.035 . . . . 0.0 110.179 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.557 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 142.03 -15.08 2.59 Favored Glycine 0 C--N 1.297 -1.606 0 N-CA-C 109.309 -1.517 . . . . 0.0 109.309 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.458 ' CD1' ' CD1' ' A' ' 52' ' ' LEU . 17.6 mt -84.95 169.4 14.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.679 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.75 154.05 19.82 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.7 tptt -45.23 -58.34 3.33 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.082 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 48' ' ' GLU . 8.4 pt-20 -57.29 -26.45 60.89 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.447 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 15.6 tp10 -83.87 -25.7 30.04 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.089 -1.044 . . . . 0.0 109.878 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mp -71.38 -37.57 65.59 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.755 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.2 mt -60.13 -60.14 3.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.972 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -48.08 -36.96 14.06 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.47 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.458 ' CD1' ' CD1' ' A' ' 44' ' ' LEU . 16.3 mt -85.12 -19.62 31.56 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.132 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -83.99 -3.47 58.02 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.279 -0.969 . . . . 0.0 110.712 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -104.35 -62.35 1.33 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.097 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.592 HH21 ' CG ' ' A' ' 26' ' ' ASP . 3.9 ttt180 -44.8 -54.2 6.61 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.843 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.2 ttp85 -46.92 -35.11 6.11 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.076 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.3 ttt-85 -76.11 -34.15 59.48 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.274 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -62.78 -37.42 86.58 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.785 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.03 -46.3 78.36 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.29 -0.964 . . . . 0.0 110.604 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -55.0 -17.47 3.81 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.242 -0.983 . . . . 0.0 110.566 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -95.26 -40.38 9.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.958 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.63 ' CG ' ' H ' ' A' ' 63' ' ' GLY . 40.0 ttp85 -64.14 178.74 0.64 Allowed 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.989 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.63 ' H ' ' CG ' ' A' ' 62' ' ' ARG . . . -44.09 -39.1 5.07 Favored Glycine 0 N--CA 1.492 2.394 0 C-N-CA 119.444 -1.36 . . . . 0.0 110.114 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--N 1.304 -1.395 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.508 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.403 0.62 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 p -69.54 156.29 39.13 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.051 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.31 -35.6 72.11 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.489 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 3.9 mp0 -63.6 -27.04 68.96 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.282 -0.967 . . . . 0.0 110.506 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' VAL . 3.0 mt-10 -78.13 -49.45 13.86 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.059 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.1 mt -37.41 -24.85 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.943 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -99.08 -59.06 3.47 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.345 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.56 -45.0 9.18 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.761 -1.176 . . . . 0.0 109.119 179.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.435 ' O ' ' CG ' ' A' ' 32' ' ' MET . 2.7 ptt? -92.31 120.64 33.04 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.111 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.7 p -77.31 -165.55 0.6 Allowed 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.636 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.4 t -56.16 -49.83 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.789 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -44.37 -51.49 8.51 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.248 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 36' ' ' GLU . 2.6 mp0 -71.97 -30.12 64.94 Favored 'General case' 0 C--N 1.295 -1.799 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.452 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 tt -65.82 -45.35 82.62 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.959 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -58.71 -14.94 9.84 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.056 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -15.51 44.26 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.788 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.466 ' C ' ' H ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -99.25 -46.3 5.58 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.525 -179.835 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.619 ' CD1' ' C ' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -66.55 5.63 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.496 -179.861 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.506 ' N ' HD11 ' A' ' 41' ' ' LEU . 9.8 mtp85 -44.9 99.24 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.733 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 107.42 8.62 30.57 Favored Glycine 0 N--CA 1.483 1.813 0 C-N-CA 119.926 -1.13 . . . . 0.0 111.832 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.6 mt -84.21 151.4 24.86 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 117.437 -1.705 . . . . 0.0 110.823 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.451 ' OG ' ' OE2' ' A' ' 47' ' ' GLU . 33.7 t -78.54 171.05 15.68 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.631 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -59.87 -40.98 90.51 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.785 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.636 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -79.49 -16.98 55.12 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.707 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -89.73 -20.34 23.69 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.298 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 48.6 mt -82.89 -35.36 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.593 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.273 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.239 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.76 -50.47 63.43 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.09 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.448 HD11 ' NE2' ' A' ' 40' ' ' HIS . 27.8 mt -67.61 -20.07 65.31 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.917 -1.113 . . . . 0.0 110.387 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.26 -19.94 38.58 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.658 -0.817 . . . . 0.0 110.436 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -76.62 -59.1 2.91 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.652 -0.819 . . . . 0.0 111.034 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.9 mmt-85 -55.57 -46.86 77.13 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.356 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.434 ' NH2' ' HE3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -51.28 -35.66 38.53 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.804 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.66 -35.77 70.44 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.717 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 17.1 m -58.88 -44.31 91.12 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.069 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 44.2 mt -65.95 -50.46 64.29 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.8 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.434 ' HE3' ' NH2' ' A' ' 56' ' ' ARG . 0.3 OUTLIER -56.63 -12.15 1.68 Allowed 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.735 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -96.53 -52.32 3.99 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.545 -0.862 . . . . 0.0 111.212 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.411 HH21 ' HB3' ' A' ' 62' ' ' ARG . 26.4 mtp85 -57.43 -171.77 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.548 -0.861 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.6 -46.14 5.71 Favored Glycine 0 N--CA 1.492 2.37 0 C-N-CA 119.592 -1.289 . . . . 0.0 110.43 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.394 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.379 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 121.384 0.612 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -170.51 0.54 Allowed 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.711 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.525 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -80.5 -53.84 6.21 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.234 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.462 ' HB3' ' CZ ' ' A' ' 64' ' ' TYR . 14.2 mt-10 -58.59 -13.75 6.51 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 118.917 -1.113 . . . . 0.0 109.446 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.411 ' C ' ' N ' ' A' ' 30' ' ' VAL . 28.4 mm-40 -79.79 -49.03 12.6 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.523 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 28' ' ' GLU . 46.5 mt -41.61 -30.41 0.22 Allowed 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.117 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.412 ' H ' HG22 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -83.33 -61.86 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.338 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.68 -29.92 2.11 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.615 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 3.1 mtp -90.7 95.57 10.21 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.615 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 33.2 t -44.04 146.83 0.57 Allowed 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.712 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.465 HG21 HH21 ' A' ' 56' ' ' ARG . 2.0 t -41.37 -47.99 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.936 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -53.08 -41.82 65.27 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.902 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.524 ' OE1' ' N ' ' A' ' 36' ' ' GLU . 1.3 mp0 -73.73 -22.01 60.03 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 119.141 -1.024 . . . . 0.0 109.584 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.438 ' C ' ' N ' ' A' ' 39' ' ' GLN . 13.4 tp -79.31 -51.28 9.65 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.126 -1.03 . . . . 0.0 108.908 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.462 HD22 HG13 ' A' ' 34' ' ' VAL . 85.8 m-20 -53.26 -19.26 3.01 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.025 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.438 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -68.91 -42.76 76.42 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.52 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.458 ' CE1' HD11 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.3 -47.04 29.69 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.069 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.496 ' O ' ' N ' ' A' ' 43' ' ' GLY . 27.9 mt -42.66 -29.68 0.32 Allowed 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.087 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -45.96 95.62 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.577 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 133.46 -13.94 4.82 Favored Glycine 0 N--CA 1.484 1.838 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.458 HD11 ' CE1' ' A' ' 40' ' ' HIS . 16.4 mt -91.44 127.77 37.02 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.069 -1.052 . . . . 0.0 110.818 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.1 m -47.87 165.01 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.524 -0.871 . . . . 0.0 110.836 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 7.3 pttm -61.26 -20.52 62.95 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.001 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -85.79 -32.76 21.63 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.859 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.06 -13.35 59.82 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.079 -1.049 . . . . 0.0 109.984 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mt -81.78 -36.6 14.47 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.023 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.49 HD11 ' N ' ' A' ' 50' ' ' ILE . 1.5 mp -69.78 -33.75 57.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.69 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -64.62 -27.47 68.96 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 mp -93.53 -27.3 16.72 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.257 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -71.91 5.66 2.5 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.302 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -102.56 -64.51 1.06 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 119.831 -0.747 . . . . 0.0 111.204 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 58' ' ' THR . 38.2 mtt85 -50.86 -50.03 57.72 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.058 -1.057 . . . . 0.0 110.994 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.465 HH21 HG21 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -48.13 -33.24 7.99 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 118.971 -1.092 . . . . 0.0 110.542 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -79.3 -22.55 44.47 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.867 -1.133 . . . . 0.0 110.334 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.436 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.8 m -79.59 -42.28 25.33 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.258 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.458 ' CD1' ' O ' ' A' ' 26' ' ' ASP . 27.0 mt -58.84 -54.6 45.24 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.555 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -45.35 -22.18 0.12 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.264 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.412 ' N ' ' C ' ' A' ' 59' ' ' LEU . 27.2 t-20 -100.31 -45.9 5.44 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 119.637 -0.825 . . . . 0.0 111.906 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.505 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 11.0 ttt180 -53.37 176.53 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.23 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.505 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.8 -33.3 1.07 Allowed Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.685 -1.245 . . . . 0.0 110.318 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.462 ' CZ ' ' HB3' ' A' ' 27' ' ' GLU . 3.0 t80 . . . . . 0 C--N 1.306 -1.298 0 C-N-CA 119.316 -0.953 . . . . 0.0 110.319 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 121.417 0.627 . . . . 0.0 110.112 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.1 p -59.27 178.18 0.15 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.244 -0.982 . . . . 0.0 110.909 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -69.37 -33.72 73.47 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.09 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.613 ' CD ' ' N ' ' A' ' 27' ' ' GLU . 4.0 mp0 -63.5 -53.84 45.71 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.8 -1.16 . . . . 0.0 109.318 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.474 ' HB3' ' SD ' ' A' ' 32' ' ' MET . 21.9 mt-10 -45.51 -48.68 14.13 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.368 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.5 mt -44.91 -35.35 2.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.943 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.459 ' C ' ' N ' ' A' ' 32' ' ' MET . 2.3 t -99.87 -53.68 7.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.112 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.77 -26.16 0.23 Allowed 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.661 -1.216 . . . . 0.0 109.396 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.474 ' SD ' ' HB3' ' A' ' 28' ' ' GLU . 28.5 mtp -90.39 104.35 16.94 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.629 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 13.8 t -47.51 -96.16 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.24 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.419 ' N ' ' OG ' ' A' ' 33' ' ' SER . 47.8 t -138.04 -30.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.033 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -71.82 -52.77 15.84 Favored 'General case' 0 C--N 1.3 -1.578 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.403 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -66.2 -30.56 71.04 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.169 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.409 ' C ' ' N ' ' A' ' 39' ' ' GLN . 1.3 tt -73.99 -51.44 15.92 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -54.72 -16.8 2.78 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.8 OUTLIER -77.03 -39.22 50.97 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.337 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -38.97 34.94 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.92 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.52 ' O ' ' N ' ' A' ' 43' ' ' GLY . 16.2 mt -48.14 -30.4 4.53 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.024 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.49 ' HE ' ' HA ' ' A' ' 42' ' ' ARG . 15.0 mmm-85 -58.61 86.13 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.823 -1.151 . . . . 0.0 110.001 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 152.06 -13.11 0.73 Allowed Glycine 0 C--N 1.292 -1.893 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.6 mt -94.89 123.14 38.19 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.575 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 48' ' ' GLU . 94.0 p -66.86 155.61 37.91 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.338 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -43.82 -29.27 0.52 Allowed 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.67 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -83.56 -31.64 26.26 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.623 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 45' ' ' SER . 0.0 OUTLIER -81.71 -16.86 49.83 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.9 mt -81.63 -35.97 14.13 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.044 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -72.85 -50.06 35.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.657 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -65.89 -15.51 63.01 Favored 'General case' 0 C--N 1.296 -1.72 0 C-N-CA 119.291 -0.964 . . . . 0.0 110.297 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.573 ' CD1' ' C ' ' A' ' 52' ' ' LEU . 3.0 tm? -101.02 -51.97 3.4 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.188 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' N ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -56.5 -6.46 0.3 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.62 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.5 tt0 -72.02 -71.65 0.27 Allowed 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.46 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.3 -51.49 6.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.022 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.7 ttp85 -42.58 -36.82 1.48 Allowed 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.187 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.1 ttm-85 -72.52 -31.4 65.3 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.384 -0.926 . . . . 0.0 110.544 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.524 ' N ' ' O ' ' A' ' 55' ' ' ARG . 21.9 m -67.98 -33.26 74.31 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.767 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.6 mt -66.03 -49.75 66.61 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.122 -1.031 . . . . 0.0 110.416 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.3 mmtt -52.48 -15.67 0.72 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -93.33 -50.48 5.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.563 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -51.17 171.72 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.153 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.66 -29.88 0.83 Allowed Glycine 0 N--CA 1.492 2.419 0 C-N-CA 119.677 -1.249 . . . . 0.0 110.662 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--N 1.302 -1.475 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.736 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.3 0.572 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.452 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -83.64 176.06 9.27 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.287 -0.965 . . . . 0.0 110.458 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.33 -47.22 79.21 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.374 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -43.02 97.13 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 118.859 -1.136 . . . . 0.0 109.355 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HB2' ' N ' ' A' ' 25' ' ' THR . 12.7 mm-40 -55.11 -44.74 75.23 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.649 -0.821 . . . . 0.0 111.367 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 14.2 mt -47.53 -34.02 7.09 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.422 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' THR . 2.7 t -94.13 -56.35 5.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 119.555 -0.858 . . . . 0.0 111.828 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.96 -29.66 0.87 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.002 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 29' ' ' LEU . 12.8 ptm -92.42 120.74 33.22 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.266 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 78.1 p -63.87 -145.16 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.995 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.8 t -92.69 -42.69 13.44 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.966 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -51.6 -45.23 63.11 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.949 -1.101 . . . . 0.0 110.117 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -73.23 -28.18 62.02 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.947 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.436 HD23 HH22 ' A' ' 56' ' ' ARG . 9.2 tp -72.68 -43.7 62.76 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.628 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 -56.27 -18.04 9.36 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.01 -1.076 . . . . 0.0 109.958 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -26.72 43.36 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.388 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.4 ' O ' ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -96.7 -36.97 10.5 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.692 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 43' ' ' GLY . 12.1 mt -42.28 -36.82 1.33 Allowed 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.016 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -59.46 84.37 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 119.054 -1.058 . . . . 0.0 110.053 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 156.76 -14.48 0.34 Allowed Glycine 0 C--N 1.293 -1.812 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.1 mt -96.94 129.23 44.42 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.64 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 48' ' ' GLU . 2.4 t -73.35 157.72 36.42 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.233 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -44.33 -40.0 5.0 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.228 -0.989 . . . . 0.0 110.767 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.62 -14.06 57.18 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.634 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.513 ' N ' ' O ' ' A' ' 45' ' ' SER . 25.9 tp10 -90.46 -25.25 20.42 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.462 -0.895 . . . . 0.0 109.832 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 32.1 mt -78.42 -22.36 13.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.091 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.9 mt -71.74 -62.21 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.318 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.429 ' CG ' ' N ' ' A' ' 52' ' ' LEU . 2.8 pt20 -50.64 -31.85 17.33 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.464 ' C ' ' H ' ' A' ' 54' ' ' GLN . 2.1 tp -75.15 -39.4 60.43 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.613 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HD3' ' NH2' ' A' ' 56' ' ' ARG . 37.0 mmtt -62.08 -3.55 1.3 Allowed 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.482 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.464 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.7 tt0 -88.09 -75.09 0.43 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.957 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.457 ' HG2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -49.14 -45.82 44.24 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.466 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.457 ' H ' ' HG2' ' A' ' 55' ' ' ARG . 5.1 tmm_? -53.41 -38.87 63.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.951 -1.1 . . . . 0.0 109.59 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -74.64 -34.9 62.85 Favored 'General case' 0 C--N 1.304 -1.376 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.286 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -61.18 -34.51 75.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 119.026 -1.07 . . . . 0.0 110.155 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.8 mt -69.05 -34.27 74.9 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.354 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -70.73 -9.7 57.82 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.581 -0.848 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.73 -56.99 2.34 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.665 -0.814 . . . . 0.0 111.674 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 ttt-85 -52.72 176.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -40.89 -30.96 0.4 Allowed Glycine 0 N--CA 1.494 2.541 0 C-N-CA 119.752 -1.213 . . . . 0.0 110.408 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 C--N 1.303 -1.428 0 C-N-CA 119.339 -0.944 . . . . 0.0 110.358 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.491 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 121.091 0.472 . . . . 0.0 110.407 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.7 p -55.81 179.87 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.881 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -71.53 -32.32 68.02 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 118.984 -1.087 . . . . 0.0 110.311 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -62.43 -20.73 64.79 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.083 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -87.07 -41.71 13.62 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.119 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.5 mt -41.4 -34.84 0.58 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.28 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.439 ' CG2' HD12 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -85.4 -61.7 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.711 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.923 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -26.93 0.82 Allowed 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.001 -1.08 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.5 mtp -90.3 92.1 8.78 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.979 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 34' ' ' VAL . 74.6 p -46.99 162.78 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.404 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.405 ' C ' ' O ' ' A' ' 33' ' ' SER . 21.5 t -39.9 -57.61 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.152 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.64 30.23 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.432 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.4 ' HG2' ' HG ' ' A' ' 33' ' ' SER . 14.0 mm-40 -60.19 -39.36 86.26 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.172 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.4 -49.43 60.09 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.521 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.24 -14.22 2.66 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.545 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -84.17 -33.52 24.19 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.394 -0.923 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.537 ' C ' ' H ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -85.76 -36.59 20.04 Favored 'General case' 0 C--N 1.305 -1.35 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.873 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.645 ' C ' ' H ' ' A' ' 43' ' ' GLY . 32.8 mt -47.13 -12.14 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.209 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.537 ' H ' ' C ' ' A' ' 40' ' ' HIS . 10.7 mmm180 -70.86 31.81 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.512 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.645 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -152.49 4.31 0.4 Allowed Glycine 0 C--N 1.294 -1.791 0 N-CA-C 109.261 -1.535 . . . . 0.0 109.261 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.2 mt -106.04 165.64 11.07 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.46 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.448 ' O ' ' N ' ' A' ' 49' ' ' ILE . 1.2 m -96.36 156.32 16.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.749 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -42.91 -46.04 5.21 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.124 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -71.13 -36.58 72.17 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -79.91 -11.34 59.81 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.093 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.448 ' N ' ' O ' ' A' ' 45' ' ' SER . 45.6 mt -90.49 -40.95 13.18 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.693 -0.803 . . . . 0.0 110.675 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -58.13 -56.93 12.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.124 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -51.05 -29.06 11.75 Favored 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.776 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.63 -35.25 45.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.937 -1.105 . . . . 0.0 111.343 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.4 mttt -59.3 -21.67 60.05 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.406 -0.918 . . . . 0.0 111.526 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.477 ' O ' ' N ' ' A' ' 57' ' ' ARG . 8.7 tt0 -98.88 -69.8 0.75 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.524 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.2 OUTLIER -40.33 -50.9 2.81 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.214 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.425 ' NH1' ' HD2' ' A' ' 57' ' ' ARG . 1.0 OUTLIER -46.95 -36.03 7.2 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 118.79 -1.164 . . . . 0.0 109.927 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 54' ' ' GLN . 5.4 tpt85 -77.01 -18.94 57.85 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.474 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.522 ' N ' ' O ' ' A' ' 55' ' ' ARG . 3.3 m -82.64 -34.62 27.46 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.02 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.439 HD12 ' CG2' ' A' ' 30' ' ' VAL . 15.3 mt -51.95 -51.81 54.54 Favored 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.895 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -49.14 -17.97 0.28 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.992 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 59' ' ' LEU . 66.1 m-20 -106.14 -35.24 7.28 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.007 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.503 ' NE ' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -62.45 -169.64 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.505 -0.878 . . . . 0.0 110.948 -179.969 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.503 ' H ' ' NE ' ' A' ' 62' ' ' ARG . . . -43.86 -56.36 5.14 Favored Glycine 0 N--CA 1.491 2.326 0 C-N-CA 119.504 -1.331 . . . . 0.0 110.696 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.486 1.347 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.192 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.454 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.391 0.615 . . . . 0.0 109.98 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.7 p -63.64 -178.4 0.29 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.735 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -75.26 -36.13 61.3 Favored 'General case' 0 C--N 1.3 -1.587 0 C-N-CA 119.306 -0.957 . . . . 0.0 110.286 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.625 ' OE1' ' CE1' ' A' ' 64' ' ' TYR . 18.2 mm-40 -68.91 -6.87 29.99 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.935 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -90.34 -49.98 6.22 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 62.5 mt -43.05 -37.73 2.05 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.451 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.7 t -76.96 -55.33 11.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.177 -1.009 . . . . 0.0 110.525 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -48.52 -29.35 4.1 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.467 -1.293 . . . . 0.0 108.648 179.805 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 58.3 mtp -90.84 104.22 16.83 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.159 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m -46.65 -92.78 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.827 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.89 -30.4 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 C-N-CA 119.586 -0.846 . . . . 0.0 109.846 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -74.8 -36.68 62.48 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.308 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.92 -26.43 48.99 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.473 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.1 tp -79.2 -46.23 18.29 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.525 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -68.05 -8.54 38.66 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.664 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.532 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 1.8 mm-40 -80.83 -24.9 38.12 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.033 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.454 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -104.87 -30.11 10.07 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.369 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.653 ' C ' ' H ' ' A' ' 43' ' ' GLY . 17.2 mt -57.93 -37.33 73.88 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.585 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -55.51 -0.27 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.813 -1.155 . . . . 0.0 110.936 -179.86 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.653 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -100.37 -9.87 46.29 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.0 mt -98.5 178.11 5.13 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.647 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.612 ' OG ' ' N ' ' A' ' 46' ' ' LYS . 28.7 t -79.51 -170.08 2.18 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.319 -0.952 . . . . 0.0 110.249 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.612 ' N ' ' OG ' ' A' ' 45' ' ' SER . 8.7 mtpp -79.78 -38.62 32.72 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.768 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.15 -25.17 51.69 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.462 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -78.41 -17.2 56.73 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.369 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 35.4 mt -86.12 -27.67 6.15 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.345 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.896 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.4 mt -66.16 -63.86 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.251 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -57.43 -27.92 62.83 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.54 -0.864 . . . . 0.0 111.494 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.454 ' N ' HD23 ' A' ' 52' ' ' LEU . 3.4 mm? -76.89 -28.65 55.43 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.925 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -37.68 68.59 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.587 -0.845 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -79.04 -38.4 36.64 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.196 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 58' ' ' THR . 7.1 ttt180 -56.17 -55.68 30.13 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.484 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.491 ' CD ' ' C ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -46.25 -41.34 12.82 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 118.946 -1.102 . . . . 0.0 109.526 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -66.63 -34.27 77.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.555 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.411 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.1 m -65.96 -38.33 88.29 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.544 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.41 ' C ' ' N ' ' A' ' 61' ' ' ASN . 17.2 mt -58.14 -48.93 78.74 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.067 -1.053 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.83 -23.61 0.29 Allowed 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.254 -0.978 . . . . 0.0 110.56 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 59' ' ' LEU . 2.1 t30 -98.87 -37.33 9.47 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.167 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.7 ttt-85 -59.51 178.61 0.14 Allowed 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.976 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.89 -45.46 5.9 Favored Glycine 0 N--CA 1.493 2.439 0 C-N-CA 119.624 -1.274 . . . . 0.0 110.258 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.625 ' CE1' ' OE1' ' A' ' 27' ' ' GLU . 5.1 t80 . . . . . 0 C--N 1.302 -1.492 0 C-N-CA 119.581 -0.848 . . . . 0.0 110.451 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.438 HD21 ' CD2' ' A' ' 40' ' ' HIS . 11.0 tp . . . . . 0 C--O 1.215 -0.711 0 CA-C-O 121.356 0.598 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.2 p -62.94 177.99 0.51 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 118.557 -1.257 . . . . 0.0 110.066 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.22 -28.06 59.8 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.359 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.63 -18.09 63.57 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.94 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -90.2 -42.55 10.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.394 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.42 ' CD2' HD13 ' A' ' 37' ' ' LEU . 14.4 mt -42.62 -35.75 1.19 Allowed 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.065 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.432 ' C ' ' N ' ' A' ' 32' ' ' MET . 1.6 t -82.06 -61.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.464 -0.894 . . . . 0.0 110.873 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.33 -24.3 0.47 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 118.863 -1.135 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.432 ' N ' ' C ' ' A' ' 30' ' ' VAL . 15.0 mtp -90.31 91.41 8.48 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.827 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 40.4 t -47.64 164.62 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.95 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.3 t -41.63 -56.57 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.095 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.4 ' HE ' ' HB2' ' A' ' 35' ' ' ARG . 11.0 tpp180 -52.63 -46.79 67.24 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.474 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.97 -43.37 98.97 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.146 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.42 HD13 ' CD2' ' A' ' 29' ' ' LEU . 19.5 tp -66.78 -45.7 77.62 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.869 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -57.86 -22.84 50.1 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.193 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.3 -24.93 59.3 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.756 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.438 ' CD2' HD21 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -98.07 -19.43 17.97 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.589 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.682 ' C ' ' H ' ' A' ' 43' ' ' GLY . 30.9 mt -76.4 -23.25 54.03 Favored 'General case' 0 C--N 1.304 -1.412 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.702 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 -69.28 27.96 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.701 -1.2 . . . . 0.0 110.66 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.682 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -139.44 -3.08 1.66 Allowed Glycine 0 N--CA 1.479 1.555 0 N-CA-C 109.028 -1.629 . . . . 0.0 109.028 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.4 mt -103.03 178.75 4.47 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.991 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.4 t -90.88 153.4 20.23 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.658 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -48.73 -42.48 35.4 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.043 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.505 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 1.8 mp0 -75.85 -23.93 55.73 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.231 -0.988 . . . . 0.0 110.773 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -82.12 -19.37 40.22 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.017 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -76.06 -32.16 22.71 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 C-N-CA 119.536 -0.865 . . . . 0.0 109.696 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.461 ' N ' HD11 ' A' ' 50' ' ' ILE . 1.5 mp -70.3 -32.61 51.12 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 C-N-CA 119.659 -0.816 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -65.99 -39.04 89.98 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.043 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 93.1 mt -86.33 -34.12 20.38 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.418 -0.913 . . . . 0.0 111.253 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -62.7 -12.99 27.15 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.237 -0.985 . . . . 0.0 110.791 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.04 -68.64 0.79 Allowed 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -48.47 -47.96 38.12 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.03 -1.068 . . . . 0.0 110.386 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -47.75 -42.91 26.57 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.073 -1.051 . . . . 0.0 109.959 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -68.9 -29.53 67.82 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.284 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -66.05 -37.69 86.48 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.3 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.4 mt -66.27 -53.21 39.52 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.178 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -57.6 -14.01 4.7 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.446 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -90.13 -62.02 1.56 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.423 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 63' ' ' GLY . 10.1 ptp180 -52.4 176.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.729 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -37.8 -42.7 1.11 Allowed Glycine 0 N--CA 1.498 2.793 0 C-N-CA 120.182 -1.009 . . . . 0.0 111.009 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.304 -1.41 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.49 179.974 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.4 tp . . . . . 0 CA--C 1.491 -1.299 0 CA-C-O 121.69 0.757 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -52.21 171.31 0.05 Allowed 'General case' 0 C--N 1.283 -2.291 0 C-N-CA 118.714 -1.194 . . . . 0.0 110.637 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.18 -28.37 64.19 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.338 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -71.24 -11.55 60.98 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.73 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -89.37 -45.21 9.64 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.21 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.1 mt -41.27 -31.55 0.23 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.615 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.4 t -85.75 -61.27 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.169 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -27.75 1.16 Allowed 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 118.934 -1.106 . . . . 0.0 110.247 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.9 mtp -90.24 91.9 8.7 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.0 t -51.04 171.2 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.829 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 77.3 t -46.09 -64.41 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 119.434 -0.907 . . . . 0.0 110.98 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 27.2 ptt-85 -47.38 -42.16 21.26 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.933 -1.107 . . . . 0.0 110.207 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' A' ' 35' ' ' ARG . 9.3 tt0 -68.94 -40.01 79.21 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.875 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 tp -67.52 -43.1 81.64 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.446 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -49.49 -34.68 17.64 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.015 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -41.17 92.67 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.27 -0.972 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.03 -38.02 57.7 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.357 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.523 ' O ' ' N ' ' A' ' 43' ' ' GLY . 41.6 mt -62.8 -19.31 63.93 Favored 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.643 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.85 77.89 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.149 -1.02 . . . . 0.0 110.124 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 153.84 -10.11 0.48 Allowed Glycine 0 C--N 1.295 -1.708 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.2 mt -92.71 151.25 20.17 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.692 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -75.37 152.3 38.09 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.779 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.442 ' HG3' ' N ' ' A' ' 47' ' ' GLU . 14.6 ptpt -45.17 -41.88 8.58 Favored 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.909 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.442 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 11.5 mt-10 -75.9 -27.68 57.79 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.572 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -80.19 -19.09 47.88 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.092 -1.043 . . . . 0.0 109.91 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.6 mt -78.99 -33.17 15.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 C-N-CA 119.416 -0.914 . . . . 0.0 109.608 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.4 mt -62.35 -62.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.419 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -48.03 -30.32 4.28 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.63 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.36 -34.04 75.37 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.471 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.48 ' HD3' ' HE ' ' A' ' 56' ' ' ARG . 24.6 mmtp -77.95 -5.2 50.43 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.728 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.456 ' O ' ' N ' ' A' ' 57' ' ' ARG . 7.2 tt0 -76.03 -85.18 0.05 Allowed 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.348 -0.941 . . . . 0.0 111.031 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.463 ' HG2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -45.35 -37.77 5.23 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 119.062 -1.055 . . . . 0.0 110.497 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.48 ' HE ' ' HD3' ' A' ' 53' ' ' LYS . 42.5 ttp85 -57.87 -31.37 66.63 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.113 -1.035 . . . . 0.0 109.719 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' GLN . 22.1 ttp180 -75.91 -30.75 58.88 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.265 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -66.85 -37.73 85.02 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.527 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.6 mt -67.55 -51.87 45.56 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.578 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.459 ' HZ2' ' HB3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.31 -14.85 5.0 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.221 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -88.41 -63.62 1.27 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.426 -0.91 . . . . 0.0 112.351 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 64' ' ' TYR . 17.7 ptm180 -48.81 169.5 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.508 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -38.16 -31.24 0.1 OUTLIER Glycine 0 N--CA 1.497 2.75 0 C-N-CA 120.035 -1.079 . . . . 0.0 110.542 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.445 ' N ' ' O ' ' A' ' 62' ' ' ARG . 3.9 t80 . . . . . 0 C--N 1.302 -1.464 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.067 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 C--O 1.217 -0.658 0 CA-C-O 121.919 0.866 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.476 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -70.95 174.96 5.52 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.104 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -52.09 -50.33 61.82 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.161 -1.015 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.527 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 1.7 mp0 -65.69 -29.31 69.84 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.283 -0.967 . . . . 0.0 111.1 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.476 ' HB2' ' N ' ' A' ' 25' ' ' THR . 8.8 mt-10 -72.42 -35.85 68.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.203 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.0 mt -59.76 -44.58 93.79 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.422 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.477 ' C ' ' N ' ' A' ' 32' ' ' MET . 3.0 t -71.44 -49.66 45.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.83 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.285 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.46 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.47 -28.57 0.37 Allowed 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.076 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.477 ' N ' ' C ' ' A' ' 30' ' ' VAL . 30.4 mtp -92.4 113.13 25.32 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.577 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.7 t -49.23 -95.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.744 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 6.6 t -147.06 -27.49 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.834 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.2 ptt-85 -74.03 -40.27 62.98 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.422 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -71.98 -31.29 66.11 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.279 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 20.4 tp -72.53 -51.64 19.07 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.466 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.03 -14.44 23.34 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.68 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.58 -39.1 53.67 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.861 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.87 -26.46 22.76 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.793 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.532 ' O ' ' N ' ' A' ' 43' ' ' GLY . 15.8 mt -58.16 -32.88 68.62 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.334 -0.946 . . . . 0.0 111.059 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -64.2 76.68 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 118.841 -1.143 . . . . 0.0 110.053 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 167.07 -13.89 0.07 OUTLIER Glycine 0 C--N 1.294 -1.775 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.417 ' CD1' HD22 ' A' ' 52' ' ' LEU . 20.3 mt -87.86 170.92 10.76 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.442 ' H ' ' HB3' ' A' ' 48' ' ' GLU . 15.7 m -94.81 165.67 12.36 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.754 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -50.2 -56.83 9.44 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.22 -23.4 66.42 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 119.4 -0.92 . . . . 0.0 111.24 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.442 ' HB3' ' H ' ' A' ' 45' ' ' SER . 42.0 tt0 -84.96 -15.57 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.157 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.5 mt -89.94 -42.23 14.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.586 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mt -59.83 -49.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.012 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -54.4 -39.14 66.98 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.417 HD22 ' CD1' ' A' ' 44' ' ' LEU . 5.1 mp -73.52 -33.92 65.0 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.213 -0.995 . . . . 0.0 111.042 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.1 mttt -66.84 -5.4 12.18 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.43 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 55' ' ' ARG . 9.0 tp60 -96.89 -77.07 0.5 Allowed 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.767 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' N ' ' A' ' 58' ' ' THR . 1.2 mmp_? -42.4 -58.09 2.35 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.166 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -47.48 -38.3 13.47 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 118.782 -1.167 . . . . 0.0 109.888 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -76.7 -25.06 53.19 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.89 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' ARG . 37.0 m -77.38 -38.09 50.69 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.873 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.468 ' O ' ' N ' ' A' ' 61' ' ' ASN . 29.2 mt -59.17 -60.8 3.28 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.607 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.7 mtpp -43.38 -22.16 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.609 -0.837 . . . . 0.0 111.188 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 59' ' ' LEU . 25.0 t30 -93.56 -42.89 8.97 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.157 -1.017 . . . . 0.0 111.437 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -62.83 -160.9 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.308 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.22 96.36 Favored Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.623 -1.275 . . . . 0.0 110.903 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--N 1.305 -1.337 0 C-N-CA 119.133 -1.027 . . . . 0.0 110.859 -179.966 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.432 ' HG ' ' CE1' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.445 ' OG1' ' OE1' ' A' ' 28' ' ' GLU . 2.8 p -57.73 -175.03 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 118.796 -1.162 . . . . 0.0 110.771 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -69.9 -38.52 76.34 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.86 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 28' ' ' GLU . 6.0 pt-20 -61.35 -41.48 97.13 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.904 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.445 ' OE1' ' OG1' ' A' ' 25' ' ' THR . 0.3 OUTLIER -52.24 -49.85 63.19 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.578 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 mt -43.12 -41.5 3.68 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.65 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.66 -59.11 3.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.573 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.9 -28.56 9.89 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 118.877 -1.129 . . . . 0.0 109.435 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 34.3 mtp -91.0 96.32 10.56 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.549 -0.86 . . . . 0.0 111.078 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' N ' ' A' ' 37' ' ' LEU . 60.4 p -54.15 178.47 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.915 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 67.4 t -50.04 -61.05 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.346 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.9 ttp180 -51.01 -43.48 60.85 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.583 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -72.63 -30.97 64.78 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.208 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 33' ' ' SER . 56.2 tp -73.86 -43.65 57.94 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -65.69 -7.41 15.28 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.119 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.68 -12.83 38.38 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.762 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.432 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -98.1 -35.52 10.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.475 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.604 ' CD1' ' C ' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -77.94 14.21 1.18 Allowed 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 118.68 -1.208 . . . . 0.0 112.149 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.2 mtp85 -51.21 90.1 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.825 -1.15 . . . . 0.0 110.776 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 128.92 4.51 5.12 Favored Glycine 0 N--CA 1.484 1.861 0 C-N-CA 119.925 -1.131 . . . . 0.0 110.72 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 20.9 mt -85.15 147.18 26.74 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.126 -1.43 . . . . 0.0 110.975 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.422 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 14.8 t -80.31 175.41 10.68 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.345 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.575 ' CD ' ' H ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -60.26 -38.19 82.76 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.22 -0.992 . . . . 0.0 110.746 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -82.12 -18.0 44.47 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.502 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.422 ' HB2' ' H ' ' A' ' 45' ' ' SER . 2.4 mt-10 -87.62 -23.75 24.17 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.247 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 42.0 mt -80.65 -32.28 12.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.099 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.52 -58.72 5.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.401 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -52.83 -33.64 50.33 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.514 -0.874 . . . . 0.0 110.802 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.459 ' N ' HD23 ' A' ' 52' ' ' LEU . 3.0 mm? -79.22 -33.37 43.77 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.236 -0.985 . . . . 0.0 110.549 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -80.93 -14.64 57.8 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.369 -0.933 . . . . 0.0 110.621 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.31 -63.2 1.16 Allowed 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.449 ' O ' ' N ' ' A' ' 58' ' ' THR . 70.9 mtt180 -45.92 -50.96 14.03 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.316 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -44.48 -38.32 4.03 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.285 -0.966 . . . . 0.0 110.444 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -75.12 -31.62 61.17 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.103 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.449 ' N ' ' O ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -68.02 -38.54 82.68 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.217 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 25.4 mt -65.21 -43.94 89.9 Favored 'General case' 0 C--N 1.306 -1.314 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.78 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -59.62 -22.36 61.73 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -95.86 -48.02 5.9 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.526 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -57.07 -175.86 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.028 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -45.59 -46.33 12.59 Favored Glycine 0 N--CA 1.49 2.289 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.304 -1.376 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.367 -179.95 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.741 ' CD1' ' H ' ' A' ' 25' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.212 -0.886 0 CA-C-O 121.371 0.605 . . . . 0.0 110.701 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.741 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -175.81 162.0 2.6 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.634 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.562 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -71.54 -46.94 58.13 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.105 -1.038 . . . . 0.0 109.998 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -20.19 39.26 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.266 -0.974 . . . . 0.0 109.852 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' VAL . 2.4 mt-10 -77.7 -47.21 19.71 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.795 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 28' ' ' GLU . 24.1 mt -39.68 -29.77 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.64 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.447 ' N ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -89.37 -63.05 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.626 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.636 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.41 -28.86 1.48 Allowed 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.042 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 6.1 mtp -88.07 91.07 8.64 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.226 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -41.34 154.59 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.968 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -39.87 -38.29 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.054 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.426 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 34.5 ttp180 -62.45 -46.68 87.44 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.032 -1.067 . . . . 0.0 109.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.426 ' CD ' ' HE ' ' A' ' 35' ' ' ARG . 2.9 mp0 -67.67 -37.95 83.07 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.326 -0.949 . . . . 0.0 109.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.86 -46.75 77.32 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.654 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -57.24 -19.83 23.76 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.17 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.41 -35.34 35.33 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.531 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.61 -37.22 42.83 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.861 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.673 ' C ' ' H ' ' A' ' 43' ' ' GLY . 49.2 mt -54.73 -13.7 1.12 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.026 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -69.9 27.7 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.361 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.673 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -144.57 -3.16 0.73 Allowed Glycine 0 C--N 1.292 -1.896 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.1 mt -107.74 149.9 27.61 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.041 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.35 152.52 30.39 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.288 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -46.43 -28.16 1.29 Allowed 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.833 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -82.46 -38.86 23.36 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.635 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -77.16 -15.1 59.66 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.056 -1.058 . . . . 0.0 109.628 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 57.6 mt -80.45 -39.07 18.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 C-N-CA 119.544 -0.862 . . . . 0.0 109.697 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mt -62.9 -62.27 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.275 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.455 ' HG3' ' N ' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -45.77 -28.97 1.16 Allowed 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.875 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -78.56 -41.78 31.08 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.246 -0.982 . . . . 0.0 110.898 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.5 mttp -50.25 -20.34 1.02 Allowed 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.422 ' O ' ' N ' ' A' ' 57' ' ' ARG . 37.9 tt0 -74.22 -73.13 0.24 Allowed 'General case' 0 C--N 1.301 -1.514 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.785 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.486 ' O ' ' N ' ' A' ' 58' ' ' THR . 4.8 mmp_? -43.15 -51.64 5.87 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.591 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -45.71 -36.48 5.01 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.808 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 54' ' ' GLN . 13.0 ttt85 -71.17 -27.96 63.9 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.647 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.486 ' N ' ' O ' ' A' ' 55' ' ' ARG . 23.8 m -72.21 -42.63 65.56 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.414 ' CD1' ' O ' ' A' ' 26' ' ' ASP . 36.7 mt -60.91 -57.97 10.39 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 118.733 -1.187 . . . . 0.0 110.498 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.41 -13.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.426 -0.909 . . . . 0.0 111.23 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.413 ' N ' ' C ' ' A' ' 59' ' ' LEU . 6.1 t-20 -91.94 -62.2 1.47 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 119.338 -0.945 . . . . 0.0 112.133 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 64' ' ' TYR . 7.6 ptm180 -51.61 173.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.26 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -39.06 -30.45 0.12 Allowed Glycine 0 N--CA 1.498 2.775 0 C-N-CA 119.889 -1.148 . . . . 0.0 110.462 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.436 ' N ' ' O ' ' A' ' 62' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.302 -1.486 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.158 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.675 ' CD1' ' CD2' ' A' ' 40' ' ' HIS . 6.0 mt . . . . . 0 CA--C 1.501 -0.913 0 CA-C-O 121.146 0.498 . . . . 0.0 110.683 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.489 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -58.06 -174.03 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.143 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.621 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -59.84 -56.89 16.12 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.752 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.54 ' H ' ' CD ' ' A' ' 27' ' ' GLU . 6.6 mp0 -64.33 -22.57 67.0 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.51 ' O ' ' CG ' ' A' ' 32' ' ' MET . 10.3 mm-40 -83.54 -9.74 58.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.207 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.8 mt -87.33 -24.75 24.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.434 -0.907 . . . . 0.0 111.141 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.441 ' O ' ' C ' ' A' ' 31' ' ' THR . 6.5 t -101.95 -39.78 6.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.066 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.452 ' HG1' ' HA ' ' A' ' 28' ' ' GLU . 0.8 OUTLIER -45.53 -46.61 14.09 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.51 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -94.44 133.72 37.73 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.052 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 83.5 p -64.72 -150.63 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.963 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -84.12 -42.35 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 119.339 -0.945 . . . . 0.0 111.302 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -56.57 -43.53 80.1 Favored 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.207 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 36' ' ' GLU . 8.9 mp0 -70.0 -26.47 64.08 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.344 -0.943 . . . . 0.0 109.918 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.449 ' CD1' ' CD1' ' A' ' 24' ' ' LEU . 36.6 tp -76.12 -54.48 6.77 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.352 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.748 ' N ' HD21 ' A' ' 38' ' ' ASN . 0.7 OUTLIER -58.89 -11.26 3.1 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.395 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.41 ' H ' ' C ' ' A' ' 37' ' ' LEU . 1.7 tt0 -76.24 -38.86 55.77 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.85 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.675 ' CD2' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -90.55 -37.42 13.86 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.562 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 43' ' ' GLY . 18.0 mt -45.94 -34.68 4.09 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.519 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.6 mtp180 -49.94 91.31 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.071 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 143.92 -15.53 2.17 Favored Glycine 0 C--N 1.295 -1.74 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.9 mt -90.44 140.29 29.86 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 119.114 -1.035 . . . . 0.0 110.682 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.474 ' H ' ' HG ' ' A' ' 45' ' ' SER . 4.0 m -56.18 -178.24 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.565 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -77.25 -21.0 54.4 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.856 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -89.15 -29.47 19.31 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.921 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.39 -14.51 59.36 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.132 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.4 mt -83.9 -43.06 17.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.446 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.469 HD11 ' N ' ' A' ' 50' ' ' ILE . 1.5 mp -62.76 -56.97 14.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.666 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.893 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.427 ' HG3' ' N ' ' A' ' 52' ' ' LEU . 9.1 pt20 -51.36 -29.86 16.79 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.851 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.427 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 1.2 mp -81.11 -25.79 36.7 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.933 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.443 ' HZ1' HD22 ' A' ' 37' ' ' LEU . 49.3 mmtt -81.62 -9.17 59.73 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.016 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -81.33 -75.14 0.3 Allowed 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.032 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -44.59 -42.38 7.31 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.279 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -50.52 -41.44 53.72 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.16 -1.016 . . . . 0.0 109.748 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.457 ' HG2' HH11 ' A' ' 57' ' ' ARG . 57.7 mmt-85 -74.96 -31.59 61.5 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.278 -0.969 . . . . 0.0 110.063 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.0 m -67.16 -38.14 84.96 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.337 -0.945 . . . . 0.0 110.409 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 19.3 mt -67.71 -34.33 76.65 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.639 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.412 ' HZ2' ' HB3' ' A' ' 60' ' ' LYS . 10.6 mtpp -67.46 -15.17 63.52 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.54 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -97.04 -49.1 5.14 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.748 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.48 ' O ' ' N ' ' A' ' 64' ' ' TYR . 57.9 ttt-85 -51.38 169.44 0.05 Allowed 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.424 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.479 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.62 -23.45 0.11 Allowed Glycine 0 N--CA 1.493 2.456 0 C-N-CA 119.608 -1.282 . . . . 0.0 110.949 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.48 ' N ' ' O ' ' A' ' 62' ' ' ARG . 6.1 t80 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.104 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.2 tp . . . . . 0 C--O 1.216 -0.7 0 CA-C-O 122.179 0.99 . . . . 0.0 110.073 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.455 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -59.54 163.86 3.88 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.777 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.09 -41.66 26.79 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.64 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -70.74 -32.42 69.58 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.713 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 28' ' ' GLU . 1.6 mp0 -66.21 -35.35 80.2 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.414 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 mt -60.25 -29.25 68.66 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.693 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.432 ' O ' ' C ' ' A' ' 31' ' ' THR . 17.1 t -92.66 -42.78 13.5 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.167 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.844 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.432 ' C ' ' O ' ' A' ' 30' ' ' VAL . 22.4 p -46.05 -37.29 6.54 Favored 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.591 -1.244 . . . . 0.0 107.803 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.6 ptm -92.92 123.84 36.47 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.856 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -66.05 -177.47 0.5 Allowed 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.019 -1.072 . . . . 0.0 110.793 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.522 ' O ' ' N ' ' A' ' 37' ' ' LEU . 44.7 t -62.23 -55.17 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.672 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -47.31 -30.02 2.88 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 118.696 -1.202 . . . . 0.0 109.432 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -85.37 -26.49 26.45 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.301 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 34' ' ' VAL . 5.0 tp -74.63 -41.21 60.79 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.149 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -51.08 -37.21 44.34 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.953 -1.099 . . . . 0.0 109.484 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.21 -37.29 77.09 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.105 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.8 -45.57 16.73 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.543 ' O ' ' N ' ' A' ' 43' ' ' GLY . 30.5 mt -50.22 -29.11 8.75 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.486 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -52.1 88.77 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.339 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 139.7 -13.27 3.17 Favored Glycine 0 N--CA 1.481 1.678 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.2 mt -97.74 137.47 36.57 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.83 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.461 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 0.4 OUTLIER -89.34 173.25 8.48 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.584 -0.846 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.5 mmtt -45.99 -46.91 16.68 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.26 -31.78 70.55 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.981 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.461 ' HB2' ' H ' ' A' ' 45' ' ' SER . 23.9 mt-10 -83.42 -21.5 32.96 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.446 ' N ' ' O ' ' A' ' 45' ' ' SER . 2.3 mt -82.42 -34.74 12.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.004 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 22.8 mt -59.49 -57.09 13.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.583 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.414 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 4.2 mm100 -42.07 -31.21 0.34 Allowed 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.168 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.535 ' C ' ' H ' ' A' ' 54' ' ' GLN . 34.2 mt -88.26 -32.86 18.3 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -64.74 4.87 0.36 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.356 -0.938 . . . . 0.0 111.008 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.535 ' H ' ' C ' ' A' ' 52' ' ' LEU . 6.3 tt0 -99.21 -89.16 0.32 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.486 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 54' ' ' GLN . 12.4 tpt180 -43.65 -50.55 7.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.688 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.429 ' HE ' HD11 ' A' ' 37' ' ' LEU . 64.7 ttt-85 -48.98 -31.18 7.01 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.766 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 54' ' ' GLN . 0.2 OUTLIER -76.67 -32.15 57.75 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.644 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 m -69.59 -41.71 75.4 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.962 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 40.8 mt -70.72 -35.29 72.63 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.134 -1.026 . . . . 0.0 110.616 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -72.6 -13.22 61.33 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.583 -0.847 . . . . 0.0 111.517 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -91.55 -67.01 0.88 Allowed 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.16 -1.016 . . . . 0.0 112.155 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.48 ' HG3' ' H ' ' A' ' 64' ' ' TYR . 4.0 ptm180 -51.11 173.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.49 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -36.32 -35.73 0.12 Allowed Glycine 0 N--CA 1.5 2.947 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.289 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.48 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--N 1.301 -1.514 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.424 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.1 tp . . . . . 0 C--O 1.216 -0.691 0 CA-C-O 121.857 0.837 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.7 p -51.3 169.31 0.05 Allowed 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.34 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.89 -8.58 55.24 Favored 'General case' 0 C--N 1.299 -1.603 0 C-N-CA 118.897 -1.121 . . . . 0.0 110.5 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.412 ' O ' ' OG1' ' A' ' 31' ' ' THR . 18.3 mt-10 -90.17 -14.54 33.32 Favored 'General case' 0 C--N 1.295 -1.798 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.237 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.469 ' HA ' ' HG1' ' A' ' 31' ' ' THR . 33.6 mm-40 -90.92 -48.87 6.75 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 119.857 -0.737 . . . . 0.0 112.014 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' A' ' 28' ' ' GLU . 14.5 mt -39.66 -46.42 1.83 Allowed 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 119.819 -0.753 . . . . 0.0 111.536 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.416 ' C ' ' N ' ' A' ' 32' ' ' MET . 12.0 t -70.78 -57.64 7.28 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.233 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.469 ' HG1' ' HA ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -51.7 -20.22 1.98 Allowed 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 118.597 -1.241 . . . . 0.0 109.444 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.416 ' N ' ' C ' ' A' ' 30' ' ' VAL . 75.2 mtp -89.98 90.61 8.23 Favored 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.646 -0.821 . . . . 0.0 110.666 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 p -49.0 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.746 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 61.1 t -139.88 -26.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 C-N-CA 119.876 -0.73 . . . . 0.0 110.307 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.484 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -76.81 -41.29 44.96 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.781 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 4.4 tp10 -76.34 -29.96 57.44 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.431 -0.908 . . . . 0.0 109.514 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.1 tp -71.44 -43.52 66.54 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.878 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -58.47 -33.97 70.36 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.316 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -33.55 68.87 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.469 ' CE1' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -93.01 -35.48 13.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.516 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.617 ' C ' ' H ' ' A' ' 43' ' ' GLY . 40.4 mt -62.7 -15.58 53.4 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.135 -1.026 . . . . 0.0 110.991 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -70.34 39.76 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.958 -1.097 . . . . 0.0 110.261 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.617 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -158.72 -2.49 0.07 OUTLIER Glycine 0 C--N 1.293 -1.807 0 N-CA-C 108.793 -1.723 . . . . 0.0 108.793 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.469 HD13 ' CE1' ' A' ' 40' ' ' HIS . 22.3 mt -107.02 157.38 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 119.831 -0.748 . . . . 0.0 110.911 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.27 -176.04 4.97 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.803 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -66.66 -39.7 88.29 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.811 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.25 -36.5 69.07 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.801 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -74.08 -19.26 60.66 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.454 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mt -80.89 -38.93 17.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.722 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.8 mt -65.31 -50.56 72.6 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.328 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.946 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -54.12 -40.84 67.71 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.288 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mp -74.15 -37.49 64.02 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.293 -0.963 . . . . 0.0 110.246 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.56 -29.64 69.28 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.991 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -86.36 -45.16 11.46 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.384 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 -51.54 -61.57 2.16 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 119.256 -0.978 . . . . 0.0 109.936 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.503 ' CD ' ' C ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -47.28 -31.03 3.47 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 118.924 -1.11 . . . . 0.0 109.217 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.64 -37.96 48.88 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -60.47 -42.17 95.68 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.338 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' A' ' 61' ' ' ASN . 13.2 mt -54.83 -47.46 74.08 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.592 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -71.28 4.95 2.47 Favored 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.286 -0.966 . . . . 0.0 110.689 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 59' ' ' LEU . 1.6 t-20 -139.65 19.16 2.52 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.477 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.466 ' HG2' ' N ' ' A' ' 63' ' ' GLY . 35.3 ttt180 -137.1 -111.24 0.18 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.121 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.466 ' N ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.87 -75.47 0.76 Allowed Glycine 0 N--CA 1.491 2.309 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.926 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--N 1.304 -1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 111.225 -179.915 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.51 ' CD1' ' C ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.237 0.542 . . . . 0.0 109.905 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.11 149.51 27.97 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.203 -0.999 . . . . 0.0 110.559 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -48.11 -40.73 24.43 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.826 -1.149 . . . . 0.0 109.941 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.21 -24.69 63.35 Favored 'General case' 0 C--N 1.299 -1.624 0 C-N-CA 119.444 -0.903 . . . . 0.0 111.214 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.49 -40.46 29.66 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.259 -0.976 . . . . 0.0 111.061 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 13.9 mt -43.15 -34.27 1.06 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.593 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.6 t -85.88 -63.41 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.728 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.301 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.26 -28.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.145 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 9.0 mtp -88.23 91.59 8.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.223 -0.991 . . . . 0.0 110.507 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.506 ' O ' ' N ' ' A' ' 37' ' ' LEU . 2.6 p -55.39 -178.76 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.899 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.466 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 45.6 t -49.58 -52.68 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 111.2 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -54.72 -54.21 44.87 Favored 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.457 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -67.08 -30.3 70.29 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.415 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 33' ' ' SER . 9.7 tp -74.3 -39.89 62.62 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.173 -1.011 . . . . 0.0 110.109 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.474 ' N ' HD21 ' A' ' 38' ' ' ASN . 1.0 OUTLIER -58.98 -20.47 53.08 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.569 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -72.0 -31.14 65.94 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.53 -43.49 10.19 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.155 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 43' ' ' GLY . 19.0 mt -45.94 -47.52 16.46 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 119.539 -0.864 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 41' ' ' LEU . 4.5 mtp85 -41.78 94.52 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.571 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 141.16 -19.45 2.68 Favored Glycine 0 C--N 1.296 -1.646 0 N-CA-C 109.065 -1.614 . . . . 0.0 109.065 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.3 mt -84.82 147.51 26.78 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.621 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 48' ' ' GLU . 52.8 p -76.61 151.91 36.08 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.742 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.477 ' H ' ' HD2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -45.6 -35.71 4.21 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.268 -0.973 . . . . 0.0 110.603 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -77.7 -31.14 52.17 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.283 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 45' ' ' SER . 5.8 tt0 -77.94 -20.52 52.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.041 -1.064 . . . . 0.0 109.12 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.6 mm -72.83 -46.46 52.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.585 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 mt -58.81 -56.02 19.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -54.8 -37.97 66.73 Favored 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.41 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.26 -39.77 65.15 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.094 -1.042 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.7 mmmp? -62.39 -11.57 16.43 Favored 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.841 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -84.48 -56.53 3.57 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -55.52 -51.39 67.2 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.027 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -49.54 -38.12 29.55 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.995 -1.082 . . . . 0.0 109.697 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -33.55 67.18 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.983 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.464 ' O ' ' N ' ' A' ' 62' ' ' ARG . 96.0 m -64.09 -41.51 97.27 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.217 -0.993 . . . . 0.0 110.485 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.7 mt -54.49 -60.35 3.47 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.754 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp -47.57 -20.47 0.26 Allowed 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.444 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -106.25 -29.66 9.67 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.594 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.477 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 15.3 ttt180 -76.39 -147.54 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.032 -1.067 . . . . 0.0 111.483 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.477 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -57.73 -61.01 7.95 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.829 -1.176 . . . . 0.0 111.611 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--N 1.305 -1.344 0 C-N-CA 119.172 -1.011 . . . . 0.0 111.546 -179.868 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.467 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.5 OUTLIER . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.95 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.472 ' H ' ' HG3' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -80.38 -157.36 0.15 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.131 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -76.85 -53.73 7.52 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.972 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' CG2' ' A' ' 31' ' ' THR . 63.1 mt-10 -62.4 -24.28 67.31 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.206 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.472 ' HG3' ' H ' ' A' ' 25' ' ' THR . 37.1 mm-40 -63.87 -29.67 70.83 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.486 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.71 -45.72 74.29 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.696 0.76 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 41.4 t -78.42 -44.19 26.58 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.006 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.493 ' HG1' ' H ' ' A' ' 32' ' ' MET . 6.6 p -51.09 -35.39 34.85 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.493 ' H ' ' HG1' ' A' ' 31' ' ' THR . 10.3 mtm -92.52 123.58 35.92 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.549 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -162.86 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.247 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.99 -48.95 36.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.944 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -61.83 -31.25 71.47 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.604 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -77.42 -36.9 52.79 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.222 -0.991 . . . . 0.0 109.928 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 tp -74.49 -42.89 58.19 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.105 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -63.23 -14.36 48.36 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.944 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.09 -32.03 64.72 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.486 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.467 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -99.09 -27.13 13.98 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.226 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.539 ' O ' ' N ' ' A' ' 43' ' ' GLY . 17.5 mt -54.05 -33.53 57.67 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 119.218 -0.993 . . . . 0.0 111.765 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.489 ' CB ' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -63.61 78.26 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.386 -179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 165.76 -14.61 0.08 OUTLIER Glycine 0 C--N 1.296 -1.679 0 N-CA-C 109.134 -1.586 . . . . 0.0 109.134 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' CD1' HD21 ' A' ' 52' ' ' LEU . 22.4 mt -88.93 152.67 21.58 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 46' ' ' LYS . 11.1 t -74.19 155.19 38.62 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.206 -0.998 . . . . 0.0 110.315 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 45' ' ' SER . 1.0 OUTLIER -41.78 -43.24 2.87 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.504 -0.878 . . . . 0.0 111.202 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.69 -48.35 72.36 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.335 -0.946 . . . . 0.0 111.103 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.3 OUTLIER -62.52 -22.62 66.43 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.698 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mm -76.01 -43.15 38.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.749 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -69.55 -40.41 79.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 C-N-CA 118.986 -1.085 . . . . 0.0 109.339 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -57.56 -49.25 76.98 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.878 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.579 ' C ' ' H ' ' A' ' 54' ' ' GLN . 6.0 mp -69.97 -42.31 73.32 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.245 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.419 ' HD2' HH21 ' A' ' 56' ' ' ARG . 0.5 OUTLIER -61.17 5.54 0.06 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.018 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.579 ' H ' ' C ' ' A' ' 52' ' ' LEU . 30.2 tt0 -100.32 -76.34 0.56 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.291 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -42.71 -47.84 5.46 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.351 -0.94 . . . . 0.0 110.506 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.419 HH21 ' HD2' ' A' ' 53' ' ' LYS . 4.2 tmm_? -45.72 -36.22 4.84 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.206 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.632 ' CA ' ' HE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -74.82 -34.29 62.32 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.46 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.463 ' N ' ' HG3' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -77.74 -36.97 50.24 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.536 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -62.53 -21.12 65.3 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.315 -0.954 . . . . 0.0 111.409 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.443 ' HZ2' ' HA ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -90.41 0.97 57.06 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -121.49 -33.32 3.66 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.665 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.417 ' CG ' ' H ' ' A' ' 63' ' ' GLY . 10.8 ttp180 -65.94 -149.1 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.582 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.417 ' H ' ' CG ' ' A' ' 62' ' ' ARG . . . -69.21 -27.57 73.6 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.379 -1.391 . . . . 0.0 110.369 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.9 t80 . . . . . 0 C--N 1.308 -1.237 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.949 -179.946 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.475 HD23 ' CG ' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 121.312 0.577 . . . . 0.0 110.513 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.464 ' OG1' ' OE1' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -78.14 -174.48 3.67 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.437 179.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -52.43 51.05 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.355 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -56.07 -38.23 70.38 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.861 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.464 ' OE1' ' OG1' ' A' ' 25' ' ' THR . 0.7 OUTLIER -53.81 -46.88 71.24 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.922 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.7 mt -47.7 -39.67 18.13 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.573 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.428 ' C ' ' N ' ' A' ' 32' ' ' MET . 2.0 t -79.25 -58.95 3.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.915 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.76 -26.66 0.69 Allowed 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.09 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.428 ' N ' ' C ' ' A' ' 30' ' ' VAL . 62.7 mtp -91.05 97.85 11.41 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.923 -1.035 . . . . 0.0 109.993 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.3 m -48.94 -94.27 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 119.821 -0.752 . . . . 0.0 111.58 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.8 t -140.58 -31.59 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.593 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.5 ptt-85 -76.86 -23.76 52.65 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.897 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.34 -31.37 18.95 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.891 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tp -74.35 -39.59 62.69 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.272 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -61.67 -14.84 34.82 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.907 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -89.99 0.04 57.32 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.496 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.475 ' CG ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -113.38 -29.21 7.3 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.373 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.597 ' CD1' ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -84.01 3.36 34.73 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.469 -1.293 . . . . 0.0 112.789 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.525 ' N ' HD12 ' A' ' 41' ' ' LEU . 5.8 mtm180 -50.86 90.68 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.999 -1.08 . . . . 0.0 110.743 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 132.65 0.37 4.44 Favored Glycine 0 N--CA 1.482 1.76 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.8 mt -89.77 124.94 35.08 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 118.719 -1.193 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.6 m -60.36 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.326 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -73.88 -38.21 64.48 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.765 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.648 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 9.9 pm0 -83.15 -11.62 57.75 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.044 -1.062 . . . . 0.0 110.565 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.61 -21.68 21.6 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 119.388 -0.925 . . . . 0.0 110.176 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.86 -27.7 15.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 C-N-CA 119.424 -0.911 . . . . 0.0 109.627 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.479 ' N ' HD12 ' A' ' 50' ' ' ILE . 1.4 mp -70.29 -33.4 54.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.534 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -58.03 -43.09 86.58 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.563 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.484 ' N ' ' CD2' ' A' ' 52' ' ' LEU . 4.4 mm? -69.49 -35.79 75.89 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.681 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.418 ' HD3' HH21 ' A' ' 56' ' ' ARG . 15.0 mmtp -64.47 -0.52 1.36 Allowed 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.0 tp60 -86.46 -79.56 0.26 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.963 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -54.08 -38.0 64.83 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.039 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.474 ' NH1' ' HZ3' ' A' ' 60' ' ' LYS . 45.9 ttp85 -59.08 -31.27 68.74 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.013 -1.075 . . . . 0.0 109.724 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -79.43 -28.45 41.71 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.3 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.9 m -71.05 -34.72 71.5 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.294 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.3 mt -69.87 -48.61 58.1 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.163 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.474 ' HZ3' ' NH1' ' A' ' 56' ' ' ARG . 37.5 mttt -63.15 -10.6 15.63 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.644 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -89.4 -62.84 1.39 Allowed 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.395 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -53.36 178.21 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.608 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.409 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -40.09 -32.49 0.39 Allowed Glycine 0 N--CA 1.495 2.599 0 C-N-CA 119.844 -1.17 . . . . 0.0 110.62 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.6 t80 . . . . . 0 C--N 1.306 -1.292 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.429 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 121.108 0.48 . . . . 0.0 110.438 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -169.47 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.761 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.576 ' C ' ' H ' ' A' ' 28' ' ' GLU . 29.2 m-20 -73.3 -58.04 3.59 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.101 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -52.67 -8.56 0.09 Allowed 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.998 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.576 ' H ' ' C ' ' A' ' 26' ' ' ASP . 2.2 mt-10 -90.57 -32.63 16.21 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.641 -0.824 . . . . 0.0 111.424 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.455 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 92.4 mt -65.45 -23.97 67.06 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.73 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.461 ' O ' ' C ' ' A' ' 31' ' ' THR . 2.9 t -96.63 -59.92 2.93 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.006 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.264 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.463 ' CG2' ' N ' ' A' ' 32' ' ' MET . 14.6 t -41.43 -32.63 0.34 Allowed 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 118.989 -1.084 . . . . 0.0 108.688 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.515 ' SD ' ' O ' ' A' ' 28' ' ' GLU . 14.6 ptm -91.06 119.24 31.05 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.415 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.489 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 41.3 t -57.86 -174.85 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.471 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.489 ' N ' ' OG ' ' A' ' 33' ' ' SER . 48.7 t -68.97 -46.18 79.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.255 -0.978 . . . . 0.0 110.672 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -50.69 -46.39 58.78 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.174 -1.01 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.96 -25.36 63.6 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.179 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.451 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -78.94 -49.33 12.98 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.236 -0.986 . . . . 0.0 109.348 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.453 ' ND2' HG11 ' A' ' 34' ' ' VAL . 69.3 m-20 -59.6 -16.98 29.46 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.913 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -78.0 -33.46 51.25 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.361 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.461 ' O ' ' N ' ' A' ' 42' ' ' ARG . 0.7 OUTLIER -89.47 -45.16 9.63 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.364 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.461 ' C ' ' H ' ' A' ' 43' ' ' GLY . 42.4 mt -46.26 -18.9 0.06 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.703 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' N ' ' O ' ' A' ' 40' ' ' HIS . 1.4 ttp180 -56.35 -10.03 0.82 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.418 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.461 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -103.76 -1.78 46.17 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.8 mt -110.31 153.51 24.78 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 119.595 -0.842 . . . . 0.0 111.05 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.413 ' O ' ' N ' ' A' ' 48' ' ' GLU . 66.4 m -84.3 154.63 22.83 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.796 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -44.61 -36.33 3.01 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.792 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -80.27 -30.2 38.36 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.589 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 tp10 -81.9 -17.01 48.7 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.529 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 70.0 mt -82.06 -33.8 11.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.819 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.3 mt -61.21 -59.32 4.46 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.814 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.401 ' H ' ' HG3' ' A' ' 51' ' ' GLN . 15.1 mt-30 -51.36 -31.14 21.14 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.139 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.1 tp -83.66 -16.15 46.16 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.422 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -81.13 -27.35 35.56 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.122 -1.031 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -68.04 -64.25 0.9 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.192 -1.003 . . . . 0.0 110.392 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.55 -54.01 5.2 Favored 'General case' 0 C--N 1.307 -1.274 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.36 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 55' ' ' ARG . 10.9 ttt180 -42.5 -35.93 1.2 Allowed 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.95 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.2 tpt85 -72.55 -31.75 65.52 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.416 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 55' ' ' ARG . 17.6 m -67.5 -33.21 74.64 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.094 -1.042 . . . . 0.0 110.295 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 26.7 mt -68.18 -36.26 79.32 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.222 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -57.16 -16.84 8.79 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.42 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.468 ' C ' ' ND2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -87.91 -53.6 4.66 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.936 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.407 ' N ' HD21 ' A' ' 61' ' ' ASN . 0.4 OUTLIER -51.06 171.15 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.933 -179.979 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -44.03 -39.28 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 119.365 -1.398 . . . . 0.0 110.004 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.302 -1.457 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.187 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 121.728 0.775 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.97 161.35 0.07 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.193 -1.003 . . . . 0.0 110.958 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.15 -41.5 94.65 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.918 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.405 ' O ' ' OG1' ' A' ' 31' ' ' THR . 2.2 pt-20 -59.66 -18.66 43.75 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.818 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.18 -55.1 3.66 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.266 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 55.0 mt -37.78 -47.91 1.05 Allowed 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.983 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.421 ' H ' HG22 ' A' ' 30' ' ' VAL . 2.3 t -67.27 -57.25 10.49 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.974 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.184 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -51.62 -27.84 12.51 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 118.577 -1.249 . . . . 0.0 108.854 179.781 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 3.2 mtp -91.34 100.3 13.11 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.34 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.1 t -59.02 159.61 6.99 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.135 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' LEU . 41.2 t -45.87 -54.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.99 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -47.63 -41.87 23.02 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 118.643 -1.223 . . . . 0.0 109.997 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -76.82 -23.65 52.78 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.722 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 34' ' ' VAL . 14.6 tp -73.37 -46.06 51.24 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.885 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.506 ' N ' HD21 ' A' ' 38' ' ' ASN . 1.0 OUTLIER -49.9 -32.43 14.57 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.059 -1.057 . . . . 0.0 110.788 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.497 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -62.18 -18.54 61.28 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.801 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -108.57 -21.33 12.76 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.873 -0.731 . . . . 0.0 111.152 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.647 ' C ' ' H ' ' A' ' 43' ' ' GLY . 31.1 mt -70.13 -23.94 63.1 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.299 -0.96 . . . . 0.0 111.695 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -62.2 6.95 0.07 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 118.613 -1.235 . . . . 0.0 110.685 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.647 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -120.53 2.62 12.36 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.1 mt -110.98 155.89 22.04 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.951 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 m -77.58 -172.68 2.66 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.333 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.458 ' HG3' ' N ' ' A' ' 47' ' ' GLU . 24.4 pttt -68.19 -49.6 59.79 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.849 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.458 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 13.3 tp10 -69.7 -26.46 64.36 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.745 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -76.91 -19.99 56.75 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.489 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.4 mt -82.25 -43.22 19.22 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 119.214 -0.995 . . . . 0.0 109.936 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 63.3 mt -62.01 -53.48 47.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 C-N-CA 119.423 -0.911 . . . . 0.0 110.28 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -49.74 -45.48 49.43 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.076 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 tp -62.49 -35.58 79.82 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.517 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -65.43 -11.3 41.41 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.248 -0.981 . . . . 0.0 111.253 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -91.0 -45.64 8.6 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.199 -1.0 . . . . 0.0 111.324 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -64.05 -56.53 14.3 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 118.836 -1.146 . . . . 0.0 110.237 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 35.6 ttt-85 -50.37 -30.74 12.94 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.988 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -77.03 -29.93 55.49 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.417 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 m -69.83 -36.24 75.44 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.867 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.7 mt -66.53 -49.07 67.71 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.079 -1.048 . . . . 0.0 110.544 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mmmt -53.58 -18.61 3.02 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.612 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -96.13 -47.49 6.04 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.278 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.491 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -56.63 179.59 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.052 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.491 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -42.59 -43.12 4.92 Favored Glycine 0 N--CA 1.493 2.467 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.661 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--N 1.303 -1.421 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.91 -179.917 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.407 ' O ' ' C ' ' A' ' 25' ' ' THR . 5.1 tp . . . . . 0 C--O 1.216 -0.684 0 CA-C-O 122.071 0.939 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.407 ' C ' ' O ' ' A' ' 24' ' ' LEU . 1.2 p -41.97 152.81 0.07 Allowed 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.727 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.592 ' CG ' HH21 ' A' ' 55' ' ' ARG . 10.1 m-20 -52.28 -38.99 59.88 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 118.783 -1.167 . . . . 0.0 110.279 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -62.69 -18.24 62.08 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 119.467 -0.893 . . . . 0.0 111.738 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -90.76 -48.71 6.87 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.876 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.7 mt -39.98 -46.99 2.18 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.565 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.467 ' C ' ' N ' ' A' ' 32' ' ' MET . 4.2 t -69.33 -61.13 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.079 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.028 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.401 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -46.03 -22.73 0.23 Allowed 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 118.888 -1.125 . . . . 0.0 109.576 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.467 ' N ' ' C ' ' A' ' 30' ' ' VAL . 28.8 mtp -91.17 92.96 8.9 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.453 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 37' ' ' LEU . 1.6 t -53.01 176.25 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.889 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 t -53.69 -62.81 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.821 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.424 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 21.1 ptt180 -50.71 -33.18 21.82 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 118.942 -1.103 . . . . 0.0 110.024 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 21.8 mt-10 -78.59 -31.83 47.38 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.614 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.492 ' N ' ' O ' ' A' ' 33' ' ' SER . 15.9 tp -73.86 -45.26 52.14 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.62 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -54.02 -32.56 54.7 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 118.997 -1.081 . . . . 0.0 110.225 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -27.32 68.28 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.662 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.403 ' CE1' HD12 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -94.33 -30.04 14.72 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.653 -0.819 . . . . 0.0 110.757 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.557 ' O ' ' N ' ' A' ' 43' ' ' GLY . 44.3 mt -72.46 -32.98 66.7 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.2 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -52.82 88.59 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.112 -1.035 . . . . 0.0 110.179 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.557 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 142.03 -15.08 2.59 Favored Glycine 0 C--N 1.297 -1.606 0 N-CA-C 109.309 -1.517 . . . . 0.0 109.309 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.458 ' CD1' ' CD1' ' A' ' 52' ' ' LEU . 17.6 mt -84.95 169.4 14.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.679 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.75 154.05 19.82 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.7 tptt -45.23 -58.34 3.33 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.082 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 48' ' ' GLU . 8.4 pt-20 -57.29 -26.45 60.89 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.447 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 15.6 tp10 -83.87 -25.7 30.04 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.089 -1.044 . . . . 0.0 109.878 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mp -71.38 -37.57 65.59 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.755 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.2 mt -60.13 -60.14 3.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.972 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -48.08 -36.96 14.06 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.47 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.458 ' CD1' ' CD1' ' A' ' 44' ' ' LEU . 16.3 mt -85.12 -19.62 31.56 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.132 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -83.99 -3.47 58.02 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.279 -0.969 . . . . 0.0 110.712 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -104.35 -62.35 1.33 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.097 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.592 HH21 ' CG ' ' A' ' 26' ' ' ASP . 3.9 ttt180 -44.8 -54.2 6.61 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.843 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.2 ttp85 -46.92 -35.11 6.11 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.076 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.3 ttt-85 -76.11 -34.15 59.48 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.274 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -62.78 -37.42 86.58 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.785 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.03 -46.3 78.36 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.29 -0.964 . . . . 0.0 110.604 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -55.0 -17.47 3.81 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.242 -0.983 . . . . 0.0 110.566 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -95.26 -40.38 9.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.958 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.63 ' CG ' ' H ' ' A' ' 63' ' ' GLY . 40.0 ttp85 -64.14 178.74 0.64 Allowed 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.989 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.63 ' H ' ' CG ' ' A' ' 62' ' ' ARG . . . -44.09 -39.1 5.07 Favored Glycine 0 N--CA 1.492 2.394 0 C-N-CA 119.444 -1.36 . . . . 0.0 110.114 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--N 1.304 -1.395 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.508 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.403 0.62 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 p -69.54 156.29 39.13 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.051 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.31 -35.6 72.11 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.489 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 3.9 mp0 -63.6 -27.04 68.96 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.282 -0.967 . . . . 0.0 110.506 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' VAL . 3.0 mt-10 -78.13 -49.45 13.86 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.059 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.1 mt -37.41 -24.85 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.943 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -99.08 -59.06 3.47 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.345 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.56 -45.0 9.18 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.761 -1.176 . . . . 0.0 109.119 179.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.435 ' O ' ' CG ' ' A' ' 32' ' ' MET . 2.7 ptt? -92.31 120.64 33.04 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.111 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.7 p -77.31 -165.55 0.6 Allowed 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.636 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.4 t -56.16 -49.83 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.789 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -44.37 -51.49 8.51 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.248 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 36' ' ' GLU . 2.6 mp0 -71.97 -30.12 64.94 Favored 'General case' 0 C--N 1.295 -1.799 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.452 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 tt -65.82 -45.35 82.62 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.959 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -58.71 -14.94 9.84 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.056 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -15.51 44.26 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.788 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.466 ' C ' ' H ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -99.25 -46.3 5.58 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.525 -179.835 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.619 ' CD1' ' C ' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -66.55 5.63 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.496 -179.861 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.506 ' N ' HD11 ' A' ' 41' ' ' LEU . 9.8 mtp85 -44.9 99.24 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.733 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 107.42 8.62 30.57 Favored Glycine 0 N--CA 1.483 1.813 0 C-N-CA 119.926 -1.13 . . . . 0.0 111.832 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.6 mt -84.21 151.4 24.86 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 117.437 -1.705 . . . . 0.0 110.823 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.451 ' OG ' ' OE2' ' A' ' 47' ' ' GLU . 33.7 t -78.54 171.05 15.68 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.631 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -59.87 -40.98 90.51 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.785 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.636 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -79.49 -16.98 55.12 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.707 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -89.73 -20.34 23.69 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.298 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 48.6 mt -82.89 -35.36 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.593 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.273 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.239 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.76 -50.47 63.43 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.09 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.448 HD11 ' NE2' ' A' ' 40' ' ' HIS . 27.8 mt -67.61 -20.07 65.31 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.917 -1.113 . . . . 0.0 110.387 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.26 -19.94 38.58 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.658 -0.817 . . . . 0.0 110.436 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -76.62 -59.1 2.91 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.652 -0.819 . . . . 0.0 111.034 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.9 mmt-85 -55.57 -46.86 77.13 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.356 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.434 ' NH2' ' HE3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -51.28 -35.66 38.53 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.804 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.66 -35.77 70.44 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.717 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 17.1 m -58.88 -44.31 91.12 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.069 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 44.2 mt -65.95 -50.46 64.29 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.8 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.434 ' HE3' ' NH2' ' A' ' 56' ' ' ARG . 0.3 OUTLIER -56.63 -12.15 1.68 Allowed 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.735 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -96.53 -52.32 3.99 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.545 -0.862 . . . . 0.0 111.212 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.411 HH21 ' HB3' ' A' ' 62' ' ' ARG . 26.4 mtp85 -57.43 -171.77 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.548 -0.861 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.6 -46.14 5.71 Favored Glycine 0 N--CA 1.492 2.37 0 C-N-CA 119.592 -1.289 . . . . 0.0 110.43 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.394 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.379 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.463 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 121.384 0.612 . . . . 0.0 110.184 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -170.51 0.54 Allowed 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.711 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.525 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -80.5 -53.84 6.21 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.234 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 64' ' ' TYR . 14.2 mt-10 -58.59 -13.75 6.51 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 118.917 -1.113 . . . . 0.0 109.446 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.411 ' C ' ' N ' ' A' ' 30' ' ' VAL . 28.4 mm-40 -79.79 -49.03 12.6 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.523 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 28' ' ' GLU . 46.5 mt -41.61 -30.41 0.22 Allowed 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.117 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.507 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -83.33 -61.86 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.338 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.68 -29.92 2.11 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.615 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 3.1 mtp -90.7 95.57 10.21 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.615 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 33.2 t -44.04 146.83 0.57 Allowed 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.712 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.465 ' H ' HG23 ' A' ' 34' ' ' VAL . 2.0 t -41.37 -47.99 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.936 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -53.08 -41.82 65.27 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.902 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.524 ' OE1' ' N ' ' A' ' 36' ' ' GLU . 1.3 mp0 -73.73 -22.01 60.03 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 119.141 -1.024 . . . . 0.0 109.584 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.438 ' C ' ' N ' ' A' ' 39' ' ' GLN . 13.4 tp -79.31 -51.28 9.65 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.126 -1.03 . . . . 0.0 108.908 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -53.26 -19.26 3.01 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.025 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.438 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -68.91 -42.76 76.42 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.52 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.455 ' CG ' ' N ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -75.3 -47.04 29.69 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.069 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 1.009 HD23 HD12 ' A' ' 44' ' ' LEU . 27.9 mt -42.66 -29.68 0.32 Allowed 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.087 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -45.96 95.62 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.577 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 133.46 -13.94 4.82 Favored Glycine 0 N--CA 1.484 1.838 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 1.009 HD12 HD23 ' A' ' 41' ' ' LEU . 16.4 mt -91.44 127.77 37.02 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.069 -1.052 . . . . 0.0 110.818 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.1 m -47.87 165.01 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.524 -0.871 . . . . 0.0 110.836 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.561 ' O ' HD13 ' A' ' 50' ' ' ILE . 7.3 pttm -61.26 -20.52 62.95 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.001 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -85.79 -32.76 21.63 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.859 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.06 -13.35 59.82 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.079 -1.049 . . . . 0.0 109.984 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mt -81.78 -36.6 14.47 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.023 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 46' ' ' LYS . 1.5 mp -69.78 -33.75 57.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.69 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -64.62 -27.47 68.96 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 mp -93.53 -27.3 16.72 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.257 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -71.91 5.66 2.5 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.302 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -102.56 -64.51 1.06 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 119.831 -0.747 . . . . 0.0 111.204 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 58' ' ' THR . 38.2 mtt85 -50.86 -50.03 57.72 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.058 -1.057 . . . . 0.0 110.994 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.423 HH21 ' CG2' ' A' ' 34' ' ' VAL . 0.8 OUTLIER -48.13 -33.24 7.99 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 118.971 -1.092 . . . . 0.0 110.542 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -79.3 -22.55 44.47 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.867 -1.133 . . . . 0.0 110.334 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.436 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.8 m -79.59 -42.28 25.33 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.258 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.507 HD13 ' CG2' ' A' ' 30' ' ' VAL . 27.0 mt -58.84 -54.6 45.24 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.555 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -45.35 -22.18 0.12 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.264 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.412 ' N ' ' C ' ' A' ' 59' ' ' LEU . 27.2 t-20 -100.31 -45.9 5.44 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 119.637 -0.825 . . . . 0.0 111.906 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.505 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 11.0 ttt180 -53.37 176.53 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.23 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.505 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.8 -33.3 1.07 Allowed Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.685 -1.245 . . . . 0.0 110.318 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 27' ' ' GLU . 3.0 t80 . . . . . 0 C--N 1.306 -1.298 0 C-N-CA 119.316 -0.953 . . . . 0.0 110.319 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.415 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 121.417 0.627 . . . . 0.0 110.112 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.1 p -59.27 178.18 0.15 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.244 -0.982 . . . . 0.0 110.909 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -69.37 -33.72 73.47 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.09 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.613 ' N ' ' CD ' ' A' ' 27' ' ' GLU . 4.0 mp0 -63.5 -53.84 45.71 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.8 -1.16 . . . . 0.0 109.318 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.471 ' HB3' ' SD ' ' A' ' 32' ' ' MET . 21.9 mt-10 -45.51 -48.68 14.13 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.368 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.509 HD22 ' HB2' ' A' ' 56' ' ' ARG . 6.5 mt -44.91 -35.35 2.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.943 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.556 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.3 t -99.87 -53.68 7.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.112 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.77 -26.16 0.23 Allowed 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.661 -1.216 . . . . 0.0 109.396 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.471 ' SD ' ' HB3' ' A' ' 28' ' ' GLU . 28.5 mtp -90.39 104.35 16.94 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.629 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 13.8 t -47.51 -96.16 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.24 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.419 ' N ' ' OG ' ' A' ' 33' ' ' SER . 47.8 t -138.04 -30.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.033 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -71.82 -52.77 15.84 Favored 'General case' 0 C--N 1.3 -1.578 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.403 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -66.2 -30.56 71.04 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.169 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD11 ' CD ' ' A' ' 56' ' ' ARG . 1.3 tt -73.99 -51.44 15.92 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -54.72 -16.8 2.78 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.8 OUTLIER -77.03 -39.22 50.97 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.337 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -38.97 34.94 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.92 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.593 HD23 HD12 ' A' ' 44' ' ' LEU . 16.2 mt -48.14 -30.4 4.53 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.024 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.523 ' HA ' ' HE ' ' A' ' 42' ' ' ARG . 15.0 mmm-85 -58.61 86.13 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.823 -1.151 . . . . 0.0 110.001 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 152.06 -13.11 0.73 Allowed Glycine 0 C--N 1.292 -1.893 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.593 HD12 HD23 ' A' ' 41' ' ' LEU . 13.6 mt -94.89 123.14 38.19 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.575 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 48' ' ' GLU . 94.0 p -66.86 155.61 37.91 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.338 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -43.82 -29.27 0.52 Allowed 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.67 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -83.56 -31.64 26.26 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.623 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 45' ' ' SER . 0.0 OUTLIER -81.71 -16.86 49.83 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.503 HG12 HD22 ' A' ' 41' ' ' LEU . 21.9 mt -81.63 -35.97 14.13 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.044 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -72.85 -50.06 35.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.657 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -65.89 -15.51 63.01 Favored 'General case' 0 C--N 1.296 -1.72 0 C-N-CA 119.291 -0.964 . . . . 0.0 110.297 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.848 HD13 ' C ' ' A' ' 52' ' ' LEU . 3.0 tm? -101.02 -51.97 3.4 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.188 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.445 ' N ' HD13 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -56.5 -6.46 0.3 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.62 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 52' ' ' LEU . 42.9 tt0 -72.02 -71.65 0.27 Allowed 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.46 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.3 -51.49 6.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.022 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.509 ' HB2' HD22 ' A' ' 29' ' ' LEU . 64.7 ttp85 -42.58 -36.82 1.48 Allowed 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.187 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.1 ttm-85 -72.52 -31.4 65.3 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.384 -0.926 . . . . 0.0 110.544 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.524 ' N ' ' O ' ' A' ' 55' ' ' ARG . 21.9 m -67.98 -33.26 74.31 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.767 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 30' ' ' VAL . 45.6 mt -66.03 -49.75 66.61 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.122 -1.031 . . . . 0.0 110.416 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.3 mmtt -52.48 -15.67 0.72 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -93.33 -50.48 5.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.563 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -51.17 171.72 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.153 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.66 -29.88 0.83 Allowed Glycine 0 N--CA 1.492 2.419 0 C-N-CA 119.677 -1.249 . . . . 0.0 110.662 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--N 1.302 -1.475 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.736 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.519 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.3 0.572 . . . . 0.0 110.575 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.467 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -83.64 176.06 9.27 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.287 -0.965 . . . . 0.0 110.458 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.33 -47.22 79.21 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.374 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -43.02 97.13 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 118.859 -1.136 . . . . 0.0 109.355 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HB2' ' N ' ' A' ' 25' ' ' THR . 12.7 mm-40 -55.11 -44.74 75.23 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.649 -0.821 . . . . 0.0 111.367 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 14.2 mt -47.53 -34.02 7.09 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.422 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.707 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.7 t -94.13 -56.35 5.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 119.555 -0.858 . . . . 0.0 111.828 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.96 -29.66 0.87 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.002 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.481 ' SD ' ' HA ' ' A' ' 29' ' ' LEU . 12.8 ptm -92.42 120.74 33.22 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.266 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 78.1 p -63.87 -145.16 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.995 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.8 t -92.69 -42.69 13.44 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.966 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -51.6 -45.23 63.11 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.949 -1.101 . . . . 0.0 110.117 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -73.23 -28.18 62.02 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.947 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.518 HD21 HH22 ' A' ' 56' ' ' ARG . 9.2 tp -72.68 -43.7 62.76 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.628 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 -56.27 -18.04 9.36 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.01 -1.076 . . . . 0.0 109.958 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -78.98 -26.72 43.36 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.388 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.4 ' O ' ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -96.7 -36.97 10.5 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.692 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 43' ' ' GLY . 12.1 mt -42.28 -36.82 1.33 Allowed 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.016 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -59.46 84.37 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 119.054 -1.058 . . . . 0.0 110.053 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 156.76 -14.48 0.34 Allowed Glycine 0 C--N 1.293 -1.812 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.602 ' CD1' HD22 ' A' ' 52' ' ' LEU . 5.1 mt -96.94 129.23 44.42 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.64 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 48' ' ' GLU . 2.4 t -73.35 157.72 36.42 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.233 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -44.33 -40.0 5.0 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.228 -0.989 . . . . 0.0 110.767 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.62 -14.06 57.18 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.634 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.513 ' N ' ' O ' ' A' ' 45' ' ' SER . 25.9 tp10 -90.46 -25.25 20.42 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.462 -0.895 . . . . 0.0 109.832 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 32.1 mt -78.42 -22.36 13.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.091 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.463 HG22 ' N ' ' A' ' 51' ' ' GLN . 9.9 mt -71.74 -62.21 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.318 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.463 ' N ' HG22 ' A' ' 50' ' ' ILE . 10.7 pt20 -50.64 -31.85 17.33 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.602 HD22 ' CD1' ' A' ' 44' ' ' LEU . 2.1 tp -75.15 -39.4 60.43 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.613 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.453 ' HD3' ' NH2' ' A' ' 56' ' ' ARG . 37.0 mmtt -62.08 -3.55 1.3 Allowed 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.482 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.433 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.7 tt0 -88.09 -75.09 0.43 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.957 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.474 ' HE ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -49.14 -45.82 44.24 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.466 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.518 HH22 HD21 ' A' ' 37' ' ' LEU . 5.1 tmm_? -53.41 -38.87 63.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.951 -1.1 . . . . 0.0 109.59 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -74.64 -34.9 62.85 Favored 'General case' 0 C--N 1.304 -1.376 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.286 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -61.18 -34.51 75.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 119.026 -1.07 . . . . 0.0 110.155 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.707 ' HB3' HG21 ' A' ' 30' ' ' VAL . 37.8 mt -69.05 -34.27 74.9 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.354 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -70.73 -9.7 57.82 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.581 -0.848 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.73 -56.99 2.34 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.665 -0.814 . . . . 0.0 111.674 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 ttt-85 -52.72 176.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -40.89 -30.96 0.4 Allowed Glycine 0 N--CA 1.494 2.541 0 C-N-CA 119.752 -1.213 . . . . 0.0 110.408 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 C--N 1.303 -1.428 0 C-N-CA 119.339 -0.944 . . . . 0.0 110.358 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.508 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 121.091 0.472 . . . . 0.0 110.407 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.419 ' H ' HG23 ' A' ' 25' ' ' THR . 44.7 p -55.81 179.87 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.881 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -71.53 -32.32 68.02 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 118.984 -1.087 . . . . 0.0 110.311 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.431 ' HG3' ' H ' ' A' ' 27' ' ' GLU . 19.0 mt-10 -62.43 -20.73 64.79 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -87.07 -41.71 13.62 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.119 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 56' ' ' ARG . 6.5 mt -41.4 -34.84 0.58 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.28 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.547 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -85.4 -61.7 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.711 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.923 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -26.93 0.82 Allowed 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.001 -1.08 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.5 mtp -90.3 92.1 8.78 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.979 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 34' ' ' VAL . 74.6 p -46.99 162.78 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.404 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 34' ' ' VAL . 21.5 t -39.9 -57.61 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.152 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.64 30.23 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.432 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -60.19 -39.36 86.26 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.172 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.4 -49.43 60.09 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.521 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.24 -14.22 2.66 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.545 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -84.17 -33.52 24.19 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.394 -0.923 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.531 ' O ' ' N ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -85.76 -36.59 20.04 Favored 'General case' 0 C--N 1.305 -1.35 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.873 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.708 HD23 HD12 ' A' ' 44' ' ' LEU . 32.8 mt -47.13 -12.14 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.209 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 40' ' ' HIS . 10.7 mmm180 -70.86 31.81 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.512 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.607 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -152.49 4.31 0.4 Allowed Glycine 0 C--N 1.294 -1.791 0 N-CA-C 109.261 -1.535 . . . . 0.0 109.261 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.708 HD12 HD23 ' A' ' 41' ' ' LEU . 15.2 mt -106.04 165.64 11.07 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.46 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.448 ' O ' ' N ' ' A' ' 49' ' ' ILE . 1.2 m -96.36 156.32 16.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.749 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -42.91 -46.04 5.21 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.124 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -71.13 -36.58 72.17 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -79.91 -11.34 59.81 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.093 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.448 ' N ' ' O ' ' A' ' 45' ' ' SER . 45.6 mt -90.49 -40.95 13.18 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.693 -0.803 . . . . 0.0 110.675 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -58.13 -56.93 12.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.124 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -51.05 -29.06 11.75 Favored 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.776 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.416 HD22 ' CD1' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -78.63 -35.25 45.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.937 -1.105 . . . . 0.0 111.343 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.4 mttt -59.3 -21.67 60.05 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.406 -0.918 . . . . 0.0 111.526 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.421 ' O ' ' N ' ' A' ' 57' ' ' ARG . 8.7 tt0 -98.88 -69.8 0.75 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.524 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.2 OUTLIER -40.33 -50.9 2.81 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.214 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.535 ' HB2' HD22 ' A' ' 29' ' ' LEU . 1.0 OUTLIER -46.95 -36.03 7.2 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 118.79 -1.164 . . . . 0.0 109.927 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.447 ' HD2' ' NH1' ' A' ' 56' ' ' ARG . 5.4 tpt85 -77.01 -18.94 57.85 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.474 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.522 ' N ' ' O ' ' A' ' 55' ' ' ARG . 3.3 m -82.64 -34.62 27.46 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.02 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.547 HD13 ' CG2' ' A' ' 30' ' ' VAL . 15.3 mt -51.95 -51.81 54.54 Favored 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.895 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -49.14 -17.97 0.28 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.992 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 59' ' ' LEU . 66.1 m-20 -106.14 -35.24 7.28 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.007 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.498 ' NE ' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -62.45 -169.64 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.505 -0.878 . . . . 0.0 110.948 -179.969 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.498 ' H ' ' NE ' ' A' ' 62' ' ' ARG . . . -43.86 -56.36 5.14 Favored Glycine 0 N--CA 1.491 2.326 0 C-N-CA 119.504 -1.331 . . . . 0.0 110.696 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.486 1.347 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.192 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.492 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.391 0.615 . . . . 0.0 109.98 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.7 p -63.64 -178.4 0.29 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.735 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -75.26 -36.13 61.3 Favored 'General case' 0 C--N 1.3 -1.587 0 C-N-CA 119.306 -0.957 . . . . 0.0 110.286 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.625 ' OE1' ' CE1' ' A' ' 64' ' ' TYR . 18.2 mm-40 -68.91 -6.87 29.99 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.935 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -90.34 -49.98 6.22 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.444 HD23 HD13 ' A' ' 37' ' ' LEU . 62.5 mt -43.05 -37.73 2.05 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.451 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.51 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.7 t -76.96 -55.33 11.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.177 -1.009 . . . . 0.0 110.525 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -48.52 -29.35 4.1 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.467 -1.293 . . . . 0.0 108.648 179.805 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 58.3 mtp -90.84 104.22 16.83 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.159 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m -46.65 -92.78 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.827 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.89 -30.4 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 C-N-CA 119.586 -0.846 . . . . 0.0 109.846 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -74.8 -36.68 62.48 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.308 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.92 -26.43 48.99 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.473 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.444 HD13 HD23 ' A' ' 29' ' ' LEU . 23.1 tp -79.2 -46.23 18.29 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.525 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -68.05 -8.54 38.66 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.664 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.532 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 1.8 mm-40 -80.83 -24.9 38.12 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.033 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.47 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -104.87 -30.11 10.07 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.369 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.624 HD23 HD12 ' A' ' 44' ' ' LEU . 17.2 mt -57.93 -37.33 73.88 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.585 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -55.51 -0.27 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.813 -1.155 . . . . 0.0 110.936 -179.86 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.613 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -100.37 -9.87 46.29 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.624 HD12 HD23 ' A' ' 41' ' ' LEU . 67.0 mt -98.5 178.11 5.13 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.647 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.612 ' OG ' ' N ' ' A' ' 46' ' ' LYS . 28.7 t -79.51 -170.08 2.18 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.319 -0.952 . . . . 0.0 110.249 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.612 ' N ' ' OG ' ' A' ' 45' ' ' SER . 8.7 mtpp -79.78 -38.62 32.72 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.768 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.15 -25.17 51.69 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.462 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.437 ' O ' HD23 ' A' ' 52' ' ' LEU . 46.3 mm-40 -78.41 -17.2 56.73 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.369 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.413 HD12 ' O ' ' A' ' 45' ' ' SER . 35.4 mt -86.12 -27.67 6.15 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.345 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.896 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.5 HG22 ' N ' ' A' ' 51' ' ' GLN . 12.4 mt -66.16 -63.86 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.5 ' N ' HG22 ' A' ' 50' ' ' ILE . 75.0 mt-30 -57.43 -27.92 62.83 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.54 -0.864 . . . . 0.0 111.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 48' ' ' GLU . 3.4 mm? -76.89 -28.65 55.43 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.925 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -37.68 68.59 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.587 -0.845 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -79.04 -38.4 36.64 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.196 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 58' ' ' THR . 7.1 ttt180 -56.17 -55.68 30.13 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.484 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.491 ' C ' ' CD ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -46.25 -41.34 12.82 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 118.946 -1.102 . . . . 0.0 109.526 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -66.63 -34.27 77.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.555 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.411 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.1 m -65.96 -38.33 88.29 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.544 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.51 HD13 ' CG2' ' A' ' 30' ' ' VAL . 17.2 mt -58.14 -48.93 78.74 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.067 -1.053 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.83 -23.61 0.29 Allowed 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.254 -0.978 . . . . 0.0 110.56 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 59' ' ' LEU . 2.1 t30 -98.87 -37.33 9.47 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.167 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.7 ttt-85 -59.51 178.61 0.14 Allowed 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.976 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.89 -45.46 5.9 Favored Glycine 0 N--CA 1.493 2.439 0 C-N-CA 119.624 -1.274 . . . . 0.0 110.258 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.625 ' CE1' ' OE1' ' A' ' 27' ' ' GLU . 5.1 t80 . . . . . 0 C--N 1.302 -1.492 0 C-N-CA 119.581 -0.848 . . . . 0.0 110.451 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.525 HD11 ' SD ' ' A' ' 32' ' ' MET . 11.0 tp . . . . . 0 C--O 1.215 -0.711 0 CA-C-O 121.356 0.598 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.2 p -62.94 177.99 0.51 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 118.557 -1.257 . . . . 0.0 110.066 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.22 -28.06 59.8 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.359 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.63 -18.09 63.57 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.94 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -90.2 -42.55 10.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.394 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.483 HD23 ' HA ' ' A' ' 29' ' ' LEU . 14.4 mt -42.62 -35.75 1.19 Allowed 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.065 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 30' ' ' VAL . 1.6 t -82.06 -61.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.464 -0.894 . . . . 0.0 110.873 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.33 -24.3 0.47 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 118.863 -1.135 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.525 ' SD ' HD11 ' A' ' 24' ' ' LEU . 15.0 mtp -90.31 91.41 8.48 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.827 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 40.4 t -47.64 164.62 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.95 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.3 t -41.63 -56.57 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.095 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.401 ' HE ' ' HB2' ' A' ' 35' ' ' ARG . 11.0 tpp180 -52.63 -46.79 67.24 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.474 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.97 -43.37 98.97 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.146 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.78 -45.7 77.62 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.869 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -57.86 -22.84 50.1 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.193 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.3 -24.93 59.3 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.756 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.477 ' CD2' HD22 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -98.07 -19.43 17.97 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.589 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.652 ' C ' ' H ' ' A' ' 43' ' ' GLY . 30.9 mt -76.4 -23.25 54.03 Favored 'General case' 0 C--N 1.304 -1.412 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.702 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 -69.28 27.96 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.701 -1.2 . . . . 0.0 110.66 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.652 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -139.44 -3.08 1.66 Allowed Glycine 0 N--CA 1.479 1.555 0 N-CA-C 109.028 -1.629 . . . . 0.0 109.028 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.45 ' CD1' HD12 ' A' ' 52' ' ' LEU . 22.4 mt -103.03 178.75 4.47 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.991 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.4 t -90.88 153.4 20.23 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.658 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -48.73 -42.48 35.4 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.043 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.505 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 1.8 mp0 -75.85 -23.93 55.73 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.231 -0.988 . . . . 0.0 110.773 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.438 ' HG3' HD13 ' A' ' 44' ' ' LEU . 25.1 tp10 -82.12 -19.37 40.22 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.017 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.486 HG22 HD12 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -76.06 -32.16 22.71 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 C-N-CA 119.536 -0.865 . . . . 0.0 109.696 179.941 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.486 HD12 HG22 ' A' ' 49' ' ' ILE . 1.5 mp -70.3 -32.61 51.12 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 C-N-CA 119.659 -0.816 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -65.99 -39.04 89.98 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.043 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 44' ' ' LEU . 93.1 mt -86.33 -34.12 20.38 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.418 -0.913 . . . . 0.0 111.253 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -62.7 -12.99 27.15 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.237 -0.985 . . . . 0.0 110.791 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.04 -68.64 0.79 Allowed 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -48.47 -47.96 38.12 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.03 -1.068 . . . . 0.0 110.386 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -47.75 -42.91 26.57 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.073 -1.051 . . . . 0.0 109.959 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -68.9 -29.53 67.82 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.284 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -66.05 -37.69 86.48 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.3 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.439 HD13 ' CG2' ' A' ' 30' ' ' VAL . 41.4 mt -66.27 -53.21 39.52 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.178 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -57.6 -14.01 4.7 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.446 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -90.13 -62.02 1.56 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.423 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 63' ' ' GLY . 10.1 ptp180 -52.4 176.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.729 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -37.8 -42.7 1.11 Allowed Glycine 0 N--CA 1.498 2.793 0 C-N-CA 120.182 -1.009 . . . . 0.0 111.009 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.304 -1.41 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.49 179.974 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 24' ' ' LEU . 13.4 tp . . . . . 0 CA--C 1.491 -1.299 0 CA-C-O 121.69 0.757 . . . . 0.0 112.109 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -52.21 171.31 0.05 Allowed 'General case' 0 C--N 1.283 -2.291 0 C-N-CA 118.714 -1.194 . . . . 0.0 110.637 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.18 -28.37 64.19 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.338 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -71.24 -11.55 60.98 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.73 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -89.37 -45.21 9.64 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.21 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.1 mt -41.27 -31.55 0.23 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.615 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.437 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.4 t -85.75 -61.27 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.169 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -27.75 1.16 Allowed 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 118.934 -1.106 . . . . 0.0 110.247 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.9 mtp -90.24 91.9 8.7 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.0 t -51.04 171.2 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.829 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 77.3 t -46.09 -64.41 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 119.434 -0.907 . . . . 0.0 110.98 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.413 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 27.2 ptt-85 -47.38 -42.16 21.26 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.933 -1.107 . . . . 0.0 110.207 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 35' ' ' ARG . 9.3 tt0 -68.94 -40.01 79.21 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.875 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.465 HD22 ' CD ' ' A' ' 56' ' ' ARG . 15.1 tp -67.52 -43.1 81.64 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.446 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -49.49 -34.68 17.64 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.015 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -41.17 92.67 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.27 -0.972 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.03 -38.02 57.7 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.357 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.916 HD23 HD12 ' A' ' 44' ' ' LEU . 41.6 mt -62.8 -19.31 63.93 Favored 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.643 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.85 77.89 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.149 -1.02 . . . . 0.0 110.124 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 153.84 -10.11 0.48 Allowed Glycine 0 C--N 1.295 -1.708 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.916 HD12 HD23 ' A' ' 41' ' ' LEU . 15.2 mt -92.71 151.25 20.17 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.692 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -75.37 152.3 38.09 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.779 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.506 ' HA ' HD12 ' A' ' 49' ' ' ILE . 14.6 ptpt -45.17 -41.88 8.58 Favored 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.909 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.449 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 11.5 mt-10 -75.9 -27.68 57.79 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.572 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -80.19 -19.09 47.88 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.092 -1.043 . . . . 0.0 109.91 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.537 HG23 HD13 ' A' ' 41' ' ' LEU . 8.6 mt -78.99 -33.17 15.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 C-N-CA 119.416 -0.914 . . . . 0.0 109.608 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.453 HG22 ' N ' ' A' ' 51' ' ' GLN . 12.4 mt -62.35 -62.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.419 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.453 ' N ' HG22 ' A' ' 50' ' ' ILE . 71.0 mt-30 -48.03 -30.32 4.28 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.63 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.499 ' HA ' HD22 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -68.36 -34.04 75.37 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.471 179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HD3' ' HE ' ' A' ' 56' ' ' ARG . 24.6 mmtp -77.95 -5.2 50.43 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.728 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.456 ' O ' ' N ' ' A' ' 57' ' ' ARG . 48.5 tt0 -76.03 -85.18 0.05 Allowed 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.348 -0.941 . . . . 0.0 111.031 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.521 ' H ' ' HD2' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -45.35 -37.77 5.23 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 119.062 -1.055 . . . . 0.0 110.497 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.538 ' HE ' ' HD3' ' A' ' 53' ' ' LYS . 42.5 ttp85 -57.87 -31.37 66.63 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.113 -1.035 . . . . 0.0 109.719 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' GLN . 22.1 ttp180 -75.91 -30.75 58.88 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.265 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -66.85 -37.73 85.02 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.527 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.437 HD13 ' CG2' ' A' ' 30' ' ' VAL . 39.6 mt -67.55 -51.87 45.56 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.578 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.406 ' HB3' ' HZ3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.31 -14.85 5.0 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.221 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -88.41 -63.62 1.27 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.426 -0.91 . . . . 0.0 112.351 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 64' ' ' TYR . 17.7 ptm180 -48.81 169.5 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.508 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -38.16 -31.24 0.1 OUTLIER Glycine 0 N--CA 1.497 2.75 0 C-N-CA 120.035 -1.079 . . . . 0.0 110.542 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.445 ' N ' ' O ' ' A' ' 62' ' ' ARG . 3.9 t80 . . . . . 0 C--N 1.302 -1.464 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.067 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.427 ' HA ' HD12 ' A' ' 24' ' ' LEU . 1.1 tp . . . . . 0 C--O 1.217 -0.658 0 CA-C-O 121.919 0.866 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.496 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -70.95 174.96 5.52 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.104 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -52.09 -50.33 61.82 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.161 -1.015 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.609 ' H ' ' CD ' ' A' ' 27' ' ' GLU . 1.7 mp0 -65.69 -29.31 69.84 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.283 -0.967 . . . . 0.0 111.1 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.496 ' HB2' ' N ' ' A' ' 25' ' ' THR . 8.8 mt-10 -72.42 -35.85 68.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.203 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 29' ' ' LEU . 49.0 mt -59.76 -44.58 93.79 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.422 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.477 ' C ' ' N ' ' A' ' 32' ' ' MET . 3.0 t -71.44 -49.66 45.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.83 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.285 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.46 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.47 -28.57 0.37 Allowed 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.076 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.477 ' N ' ' C ' ' A' ' 30' ' ' VAL . 30.4 mtp -92.4 113.13 25.32 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.577 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.7 t -49.23 -95.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.744 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.426 HG12 ' ND2' ' A' ' 38' ' ' ASN . 6.6 t -147.06 -27.49 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.834 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.4 ' HG2' ' H ' ' A' ' 35' ' ' ARG . 9.2 ptt-85 -74.03 -40.27 62.98 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.422 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -71.98 -31.29 66.11 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.279 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 20.4 tp -72.53 -51.64 19.07 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.466 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.426 ' ND2' HG12 ' A' ' 34' ' ' VAL . 98.4 m-20 -61.03 -14.44 23.34 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.68 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -39.1 53.67 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.861 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.87 -26.46 22.76 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.793 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.649 HD23 HD12 ' A' ' 44' ' ' LEU . 15.8 mt -58.16 -32.88 68.62 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.334 -0.946 . . . . 0.0 111.059 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -64.2 76.68 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 118.841 -1.143 . . . . 0.0 110.053 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 167.07 -13.89 0.07 OUTLIER Glycine 0 C--N 1.294 -1.775 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.649 HD12 HD23 ' A' ' 41' ' ' LEU . 20.3 mt -87.86 170.92 10.76 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.505 ' H ' ' HB3' ' A' ' 48' ' ' GLU . 15.7 m -94.81 165.67 12.36 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.754 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -50.2 -56.83 9.44 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.22 -23.4 66.42 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 119.4 -0.92 . . . . 0.0 111.24 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.505 ' HB3' ' H ' ' A' ' 45' ' ' SER . 42.0 tt0 -84.96 -15.57 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.157 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.5 mt -89.94 -42.23 14.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.586 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mt -59.83 -49.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.012 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -54.4 -39.14 66.98 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.421 HD22 ' CD1' ' A' ' 44' ' ' LEU . 5.1 mp -73.52 -33.92 65.0 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.213 -0.995 . . . . 0.0 111.042 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.1 mttt -66.84 -5.4 12.18 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.43 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 55' ' ' ARG . 9.0 tp60 -96.89 -77.07 0.5 Allowed 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.767 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' N ' ' A' ' 58' ' ' THR . 1.2 mmp_? -42.4 -58.09 2.35 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.166 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -47.48 -38.3 13.47 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 118.782 -1.167 . . . . 0.0 109.888 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -76.7 -25.06 53.19 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.89 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' ARG . 37.0 m -77.38 -38.09 50.69 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.873 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.468 ' O ' ' N ' ' A' ' 61' ' ' ASN . 29.2 mt -59.17 -60.8 3.28 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.607 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.421 ' HG3' HG13 ' A' ' 30' ' ' VAL . 15.7 mtpp -43.38 -22.16 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.609 -0.837 . . . . 0.0 111.188 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 59' ' ' LEU . 25.0 t30 -93.56 -42.89 8.97 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.157 -1.017 . . . . 0.0 111.437 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -62.83 -160.9 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.308 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.22 96.36 Favored Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.623 -1.275 . . . . 0.0 110.903 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--N 1.305 -1.337 0 C-N-CA 119.133 -1.027 . . . . 0.0 110.859 -179.966 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.498 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.445 ' OG1' ' OE1' ' A' ' 28' ' ' GLU . 2.8 p -57.73 -175.03 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 118.796 -1.162 . . . . 0.0 110.771 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -69.9 -38.52 76.34 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.86 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 27' ' ' GLU . 6.0 pt-20 -61.35 -41.48 97.13 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.904 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.445 ' OE1' ' OG1' ' A' ' 25' ' ' THR . 0.3 OUTLIER -52.24 -49.85 63.19 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.578 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.474 HD21 HD11 ' A' ' 24' ' ' LEU . 57.7 mt -43.12 -41.5 3.68 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.65 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.45 ' CG2' HD13 ' A' ' 59' ' ' LEU . 2.2 t -78.66 -59.11 3.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.573 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.9 -28.56 9.89 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 118.877 -1.129 . . . . 0.0 109.435 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 34.3 mtp -91.0 96.32 10.56 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.549 -0.86 . . . . 0.0 111.078 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' N ' ' A' ' 37' ' ' LEU . 60.4 p -54.15 178.47 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.915 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 67.4 t -50.04 -61.05 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.346 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.9 ttp180 -51.01 -43.48 60.85 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.583 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -72.63 -30.97 64.78 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.208 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 33' ' ' SER . 56.2 tp -73.86 -43.65 57.94 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.411 ' O ' HD11 ' A' ' 41' ' ' LEU . 68.3 m-20 -65.69 -7.41 15.28 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.119 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.68 -12.83 38.38 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.762 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -98.1 -35.52 10.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.475 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.643 ' CB ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -77.94 14.21 1.18 Allowed 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 118.68 -1.208 . . . . 0.0 112.149 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.573 ' N ' HD12 ' A' ' 41' ' ' LEU . 36.2 mtp85 -51.21 90.1 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.825 -1.15 . . . . 0.0 110.776 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 128.92 4.51 5.12 Favored Glycine 0 N--CA 1.484 1.861 0 C-N-CA 119.925 -1.131 . . . . 0.0 110.72 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.643 HD12 ' CB ' ' A' ' 41' ' ' LEU . 20.9 mt -85.15 147.18 26.74 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.126 -1.43 . . . . 0.0 110.975 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.481 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 14.8 t -80.31 175.41 10.68 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.345 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.656 ' H ' ' CD ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -60.26 -38.19 82.76 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.22 -0.992 . . . . 0.0 110.746 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -82.12 -18.0 44.47 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.502 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.481 ' HB2' ' H ' ' A' ' 45' ' ' SER . 2.4 mt-10 -87.62 -23.75 24.17 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.247 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.522 HG12 HD22 ' A' ' 41' ' ' LEU . 42.0 mt -80.65 -32.28 12.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.099 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.52 -58.72 5.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.401 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -52.83 -33.64 50.33 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.514 -0.874 . . . . 0.0 110.802 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.22 -33.37 43.77 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.236 -0.985 . . . . 0.0 110.549 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -80.93 -14.64 57.8 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.369 -0.933 . . . . 0.0 110.621 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.31 -63.2 1.16 Allowed 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.449 ' O ' ' N ' ' A' ' 58' ' ' THR . 70.9 mtt180 -45.92 -50.96 14.03 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.316 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -44.48 -38.32 4.03 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.285 -0.966 . . . . 0.0 110.444 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -75.12 -31.62 61.17 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.103 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.449 ' N ' ' O ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -68.02 -38.54 82.68 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.217 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.45 HD13 ' CG2' ' A' ' 30' ' ' VAL . 25.4 mt -65.21 -43.94 89.9 Favored 'General case' 0 C--N 1.306 -1.314 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.78 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -59.62 -22.36 61.73 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -95.86 -48.02 5.9 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.526 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -57.07 -175.86 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.028 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -45.59 -46.33 12.59 Favored Glycine 0 N--CA 1.49 2.289 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.304 -1.376 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.367 -179.95 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.764 ' CD1' ' H ' ' A' ' 25' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.212 -0.886 0 CA-C-O 121.371 0.605 . . . . 0.0 110.701 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.764 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -175.81 162.0 2.6 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.634 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.562 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -71.54 -46.94 58.13 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.105 -1.038 . . . . 0.0 109.998 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -20.19 39.26 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.266 -0.974 . . . . 0.0 109.852 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' VAL . 2.4 mt-10 -77.7 -47.21 19.71 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.795 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 28' ' ' GLU . 24.1 mt -39.68 -29.77 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.64 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.485 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -89.37 -63.05 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.626 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.636 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.41 -28.86 1.48 Allowed 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.042 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 6.1 mtp -88.07 91.07 8.64 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.226 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -41.34 154.59 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.968 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -39.87 -38.29 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.054 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.457 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 34.5 ttp180 -62.45 -46.68 87.44 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.032 -1.067 . . . . 0.0 109.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.457 ' CD ' ' HE ' ' A' ' 35' ' ' ARG . 2.9 mp0 -67.67 -37.95 83.07 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.326 -0.949 . . . . 0.0 109.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.86 -46.75 77.32 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.654 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -57.24 -19.83 23.76 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.17 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.41 -35.34 35.33 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.531 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.61 -37.22 42.83 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.861 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.65 ' C ' ' H ' ' A' ' 43' ' ' GLY . 49.2 mt -54.73 -13.7 1.12 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.026 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -69.9 27.7 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.361 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.65 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -144.57 -3.16 0.73 Allowed Glycine 0 C--N 1.292 -1.896 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.1 mt -107.74 149.9 27.61 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.041 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.35 152.52 30.39 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.288 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.543 ' HA ' HD12 ' A' ' 49' ' ' ILE . 6.7 pttt -46.43 -28.16 1.29 Allowed 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.833 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -82.46 -38.86 23.36 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.635 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -77.16 -15.1 59.66 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.056 -1.058 . . . . 0.0 109.628 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 46' ' ' LYS . 57.6 mt -80.45 -39.07 18.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 C-N-CA 119.544 -0.862 . . . . 0.0 109.697 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.489 HG22 ' N ' ' A' ' 51' ' ' GLN . 9.5 mt -62.9 -62.27 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.275 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.489 ' N ' HG22 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -45.77 -28.97 1.16 Allowed 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.875 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.44 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -78.56 -41.78 31.08 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.246 -0.982 . . . . 0.0 110.898 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.5 mttp -50.25 -20.34 1.02 Allowed 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.422 ' O ' ' N ' ' A' ' 57' ' ' ARG . 37.9 tt0 -74.22 -73.13 0.24 Allowed 'General case' 0 C--N 1.301 -1.514 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.785 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 58' ' ' THR . 4.8 mmp_? -43.15 -51.64 5.87 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.591 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -45.71 -36.48 5.01 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.808 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 54' ' ' GLN . 13.0 ttt85 -71.17 -27.96 63.9 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.647 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.483 ' N ' ' O ' ' A' ' 55' ' ' ARG . 23.8 m -72.21 -42.63 65.56 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.485 HD13 ' CG2' ' A' ' 30' ' ' VAL . 36.7 mt -60.91 -57.97 10.39 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 118.733 -1.187 . . . . 0.0 110.498 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.41 -13.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.426 -0.909 . . . . 0.0 111.23 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.413 ' N ' ' C ' ' A' ' 59' ' ' LEU . 65.6 t30 -91.94 -62.2 1.47 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 119.338 -0.945 . . . . 0.0 112.133 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 64' ' ' TYR . 7.6 ptm180 -51.61 173.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.26 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -39.06 -30.45 0.12 Allowed Glycine 0 N--CA 1.498 2.775 0 C-N-CA 119.889 -1.148 . . . . 0.0 110.462 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.436 ' N ' ' O ' ' A' ' 62' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.302 -1.486 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.158 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.475 ' CD1' ' ND1' ' A' ' 40' ' ' HIS . 6.0 mt . . . . . 0 CA--C 1.501 -0.913 0 CA-C-O 121.146 0.498 . . . . 0.0 110.683 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.503 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -58.06 -174.03 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.143 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.621 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -59.84 -56.89 16.12 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.752 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 31' ' ' THR . 6.6 mp0 -64.33 -22.57 67.0 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.51 ' O ' ' CG ' ' A' ' 32' ' ' MET . 10.3 mm-40 -83.54 -9.74 58.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.207 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 56' ' ' ARG . 13.8 mt -87.33 -24.75 24.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.434 -0.907 . . . . 0.0 111.141 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.699 HG21 ' HB3' ' A' ' 59' ' ' LEU . 6.5 t -101.95 -39.78 6.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.066 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.672 HG23 ' O ' ' A' ' 27' ' ' GLU . 0.8 OUTLIER -45.53 -46.61 14.09 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.51 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -94.44 133.72 37.73 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.052 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 83.5 p -64.72 -150.63 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.963 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -84.12 -42.35 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 119.339 -0.945 . . . . 0.0 111.302 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -56.57 -43.53 80.1 Favored 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.207 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 36' ' ' GLU . 8.9 mp0 -70.0 -26.47 64.08 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.344 -0.943 . . . . 0.0 109.918 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 24' ' ' LEU . 36.6 tp -76.12 -54.48 6.77 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.352 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -58.89 -11.26 3.1 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.395 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 1.7 tt0 -76.24 -38.86 55.77 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.85 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.475 ' ND1' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -90.55 -37.42 13.86 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.562 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.822 HD23 HD12 ' A' ' 44' ' ' LEU . 18.0 mt -45.94 -34.68 4.09 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.519 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.6 mtp180 -49.94 91.31 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.071 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 143.92 -15.53 2.17 Favored Glycine 0 C--N 1.295 -1.74 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.822 HD12 HD23 ' A' ' 41' ' ' LEU . 18.9 mt -90.44 140.29 29.86 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 119.114 -1.035 . . . . 0.0 110.682 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -56.18 -178.24 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.565 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.526 ' O ' HD13 ' A' ' 50' ' ' ILE . 21.6 mmtt -77.25 -21.0 54.4 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -89.15 -29.47 19.31 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.921 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.39 -14.51 59.36 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.132 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.49 HG12 HD22 ' A' ' 41' ' ' LEU . 8.4 mt -83.9 -43.06 17.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.446 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.526 HD13 ' O ' ' A' ' 46' ' ' LYS . 1.5 mp -62.76 -56.97 14.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.666 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.893 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.494 ' N ' HG22 ' A' ' 50' ' ' ILE . 18.8 pt20 -51.36 -29.86 16.79 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.851 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.443 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 1.2 mp -81.11 -25.79 36.7 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.933 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -81.62 -9.17 59.73 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.016 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -81.33 -75.14 0.3 Allowed 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.032 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -44.59 -42.38 7.31 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.279 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.432 ' HB2' HD22 ' A' ' 29' ' ' LEU . 7.7 ttt-85 -50.52 -41.44 53.72 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.16 -1.016 . . . . 0.0 109.748 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.485 ' HG2' HH11 ' A' ' 57' ' ' ARG . 57.7 mmt-85 -74.96 -31.59 61.5 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.278 -0.969 . . . . 0.0 110.063 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.0 m -67.16 -38.14 84.96 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.337 -0.945 . . . . 0.0 110.409 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.699 ' HB3' HG21 ' A' ' 30' ' ' VAL . 19.3 mt -67.71 -34.33 76.65 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.639 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HZ2' ' HB3' ' A' ' 60' ' ' LYS . 10.6 mtpp -67.46 -15.17 63.52 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.54 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -97.04 -49.1 5.14 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.748 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.48 ' O ' ' N ' ' A' ' 64' ' ' TYR . 57.9 ttt-85 -51.38 169.44 0.05 Allowed 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.424 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.48 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.62 -23.45 0.11 Allowed Glycine 0 N--CA 1.493 2.456 0 C-N-CA 119.608 -1.282 . . . . 0.0 110.949 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.48 ' N ' ' O ' ' A' ' 62' ' ' ARG . 6.1 t80 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.104 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 24' ' ' LEU . 1.2 tp . . . . . 0 C--O 1.216 -0.7 0 CA-C-O 122.179 0.99 . . . . 0.0 110.073 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.471 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -59.54 163.86 3.88 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.777 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.09 -41.66 26.79 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.64 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.861 ' O ' HG23 ' A' ' 31' ' ' THR . 30.2 mt-10 -70.74 -32.42 69.58 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.713 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 28' ' ' GLU . 1.6 mp0 -66.21 -35.35 80.2 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.414 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 mt -60.25 -29.25 68.66 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.693 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.82 HG21 ' HB3' ' A' ' 59' ' ' LEU . 17.1 t -92.66 -42.78 13.5 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.167 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.844 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.861 HG23 ' O ' ' A' ' 27' ' ' GLU . 22.4 p -46.05 -37.29 6.54 Favored 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.591 -1.244 . . . . 0.0 107.803 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.6 ptm -92.92 123.84 36.47 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.856 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -66.05 -177.47 0.5 Allowed 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.019 -1.072 . . . . 0.0 110.793 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.522 ' O ' ' N ' ' A' ' 37' ' ' LEU . 44.7 t -62.23 -55.17 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.672 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -47.31 -30.02 2.88 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 118.696 -1.202 . . . . 0.0 109.432 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -85.37 -26.49 26.45 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.301 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.591 HD13 ' HE ' ' A' ' 56' ' ' ARG . 5.0 tp -74.63 -41.21 60.79 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.149 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -51.08 -37.21 44.34 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.953 -1.099 . . . . 0.0 109.484 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.21 -37.29 77.09 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.105 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.8 -45.57 16.73 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.735 HD22 HG12 ' A' ' 49' ' ' ILE . 30.5 mt -50.22 -29.11 8.75 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.486 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -52.1 88.77 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.339 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 139.7 -13.27 3.17 Favored Glycine 0 N--CA 1.481 1.678 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.2 mt -97.74 137.47 36.57 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.83 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.513 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 0.4 OUTLIER -89.34 173.25 8.48 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.584 -0.846 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.5 mmtt -45.99 -46.91 16.68 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.26 -31.78 70.55 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.981 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.513 ' HB2' ' H ' ' A' ' 45' ' ' SER . 23.9 mt-10 -83.42 -21.5 32.96 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.735 HG12 HD22 ' A' ' 41' ' ' LEU . 2.3 mt -82.42 -34.74 12.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.004 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 22.8 mt -59.49 -57.09 13.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.583 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.431 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 4.2 mm100 -42.07 -31.21 0.34 Allowed 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.168 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.5 ' C ' ' H ' ' A' ' 54' ' ' GLN . 34.2 mt -88.26 -32.86 18.3 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -64.74 4.87 0.36 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.356 -0.938 . . . . 0.0 111.008 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 52' ' ' LEU . 31.7 tt0 -99.21 -89.16 0.32 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.486 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 54' ' ' GLN . 12.4 tpt180 -43.65 -50.55 7.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.688 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.591 ' HE ' HD13 ' A' ' 37' ' ' LEU . 64.7 ttt-85 -48.98 -31.18 7.01 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.766 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 54' ' ' GLN . 0.2 OUTLIER -76.67 -32.15 57.75 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.644 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 m -69.59 -41.71 75.4 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.962 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.82 ' HB3' HG21 ' A' ' 30' ' ' VAL . 40.8 mt -70.72 -35.29 72.63 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.134 -1.026 . . . . 0.0 110.616 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -72.6 -13.22 61.33 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.583 -0.847 . . . . 0.0 111.517 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -91.55 -67.01 0.88 Allowed 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.16 -1.016 . . . . 0.0 112.155 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HG3' ' H ' ' A' ' 64' ' ' TYR . 4.0 ptm180 -51.11 173.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.49 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -36.32 -35.73 0.12 Allowed Glycine 0 N--CA 1.5 2.947 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.289 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.543 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--N 1.301 -1.514 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.424 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.824 HD11 ' SD ' ' A' ' 32' ' ' MET . 9.1 tp . . . . . 0 C--O 1.216 -0.691 0 CA-C-O 121.857 0.837 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.7 p -51.3 169.31 0.05 Allowed 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.34 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.89 -8.58 55.24 Favored 'General case' 0 C--N 1.299 -1.603 0 C-N-CA 118.897 -1.121 . . . . 0.0 110.5 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.411 ' O ' ' OG1' ' A' ' 31' ' ' THR . 18.3 mt-10 -90.17 -14.54 33.32 Favored 'General case' 0 C--N 1.295 -1.798 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.237 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' LEU . 33.6 mm-40 -90.92 -48.87 6.75 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 119.857 -0.737 . . . . 0.0 112.014 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' A' ' 28' ' ' GLU . 14.5 mt -39.66 -46.42 1.83 Allowed 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 119.819 -0.753 . . . . 0.0 111.536 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.639 HG13 ' CG ' ' A' ' 60' ' ' LYS . 12.0 t -70.78 -57.64 7.28 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.233 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -51.7 -20.22 1.98 Allowed 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 118.597 -1.241 . . . . 0.0 109.444 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.824 ' SD ' HD11 ' A' ' 24' ' ' LEU . 75.2 mtp -89.98 90.61 8.23 Favored 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.646 -0.821 . . . . 0.0 110.666 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 p -49.0 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.746 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 61.1 t -139.88 -26.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 C-N-CA 119.876 -0.73 . . . . 0.0 110.307 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.484 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -76.81 -41.29 44.96 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.781 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 4.4 tp10 -76.34 -29.96 57.44 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.431 -0.908 . . . . 0.0 109.514 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.1 tp -71.44 -43.52 66.54 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.878 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -58.47 -33.97 70.36 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.316 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -33.55 68.87 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' HD11 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -93.01 -35.48 13.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.516 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.604 HD23 HD12 ' A' ' 44' ' ' LEU . 40.4 mt -62.7 -15.58 53.4 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.135 -1.026 . . . . 0.0 110.991 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -70.34 39.76 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.958 -1.097 . . . . 0.0 110.261 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.586 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -158.72 -2.49 0.07 OUTLIER Glycine 0 C--N 1.293 -1.807 0 N-CA-C 108.793 -1.723 . . . . 0.0 108.793 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 41' ' ' LEU . 22.3 mt -107.02 157.38 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 119.831 -0.748 . . . . 0.0 110.911 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.27 -176.04 4.97 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.803 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -66.66 -39.7 88.29 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.811 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.25 -36.5 69.07 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.801 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -74.08 -19.26 60.66 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.454 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mt -80.89 -38.93 17.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.722 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.8 mt -65.31 -50.56 72.6 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.328 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.946 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -54.12 -40.84 67.71 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.288 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.449 HD22 ' CD1' ' A' ' 44' ' ' LEU . 1.7 mp -74.15 -37.49 64.02 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.293 -0.963 . . . . 0.0 110.246 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.56 -29.64 69.28 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.991 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -86.36 -45.16 11.46 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.384 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 -51.54 -61.57 2.16 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 119.256 -0.978 . . . . 0.0 109.936 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.503 ' C ' ' CD ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -47.28 -31.03 3.47 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 118.924 -1.11 . . . . 0.0 109.217 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.64 -37.96 48.88 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -60.47 -42.17 95.68 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.338 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.546 HD13 HG23 ' A' ' 30' ' ' VAL . 13.2 mt -54.83 -47.46 74.08 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.592 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.639 ' CG ' HG13 ' A' ' 30' ' ' VAL . 39.2 mtpt -71.28 4.95 2.47 Favored 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.286 -0.966 . . . . 0.0 110.689 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -139.65 19.16 2.52 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.477 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 63' ' ' GLY . 35.3 ttt180 -137.1 -111.24 0.18 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.121 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.46 ' N ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.87 -75.47 0.76 Allowed Glycine 0 N--CA 1.491 2.309 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.926 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--N 1.304 -1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 111.225 -179.915 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.51 ' CD1' ' C ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.237 0.542 . . . . 0.0 109.905 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.11 149.51 27.97 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.203 -0.999 . . . . 0.0 110.559 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -48.11 -40.73 24.43 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.826 -1.149 . . . . 0.0 109.941 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.21 -24.69 63.35 Favored 'General case' 0 C--N 1.299 -1.624 0 C-N-CA 119.444 -0.903 . . . . 0.0 111.214 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.49 -40.46 29.66 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.259 -0.976 . . . . 0.0 111.061 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 29' ' ' LEU . 13.9 mt -43.15 -34.27 1.06 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.593 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.551 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.6 t -85.88 -63.41 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.728 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.301 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.26 -28.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.145 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 9.0 mtp -88.23 91.59 8.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.223 -0.991 . . . . 0.0 110.507 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.506 ' O ' ' N ' ' A' ' 37' ' ' LEU . 2.6 p -55.39 -178.76 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.899 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 45.6 t -49.58 -52.68 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 111.2 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -54.72 -54.21 44.87 Favored 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.457 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -67.08 -30.3 70.29 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.415 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 33' ' ' SER . 9.7 tp -74.3 -39.89 62.62 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.173 -1.011 . . . . 0.0 110.109 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -58.98 -20.47 53.08 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.569 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 60.3 tp60 -72.0 -31.14 65.94 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.53 -43.49 10.19 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.155 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.884 HD22 HD13 ' A' ' 49' ' ' ILE . 19.0 mt -45.94 -47.52 16.46 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 119.539 -0.864 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 41' ' ' LEU . 4.5 mtp85 -41.78 94.52 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.571 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 141.16 -19.45 2.68 Favored Glycine 0 C--N 1.296 -1.646 0 N-CA-C 109.065 -1.614 . . . . 0.0 109.065 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.795 HD12 HD23 ' A' ' 41' ' ' LEU . 19.3 mt -84.82 147.51 26.78 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.621 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 48' ' ' GLU . 52.8 p -76.61 151.91 36.08 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.742 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.554 ' H ' ' HD2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -45.6 -35.71 4.21 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.268 -0.973 . . . . 0.0 110.603 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -77.7 -31.14 52.17 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.283 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 45' ' ' SER . 5.8 tt0 -77.94 -20.52 52.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.041 -1.064 . . . . 0.0 109.12 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.884 HD13 HD22 ' A' ' 41' ' ' LEU . 1.6 mm -72.83 -46.46 52.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.585 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 mt -58.81 -56.02 19.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -54.8 -37.97 66.73 Favored 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.41 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.26 -39.77 65.15 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.094 -1.042 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.7 mmmp? -62.39 -11.57 16.43 Favored 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.841 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -84.48 -56.53 3.57 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.406 ' H ' ' HG2' ' A' ' 55' ' ' ARG . 15.1 mmt180 -55.52 -51.39 67.2 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.027 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -49.54 -38.12 29.55 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.995 -1.082 . . . . 0.0 109.697 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -33.55 67.18 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.983 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.464 ' O ' ' N ' ' A' ' 62' ' ' ARG . 96.0 m -64.09 -41.51 97.27 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.217 -0.993 . . . . 0.0 110.485 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.551 HD13 ' CG2' ' A' ' 30' ' ' VAL . 31.7 mt -54.49 -60.35 3.47 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.754 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp -47.57 -20.47 0.26 Allowed 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.444 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -106.25 -29.66 9.67 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.594 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' THR . 15.3 ttt180 -76.39 -147.54 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.032 -1.067 . . . . 0.0 111.483 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.456 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -57.73 -61.01 7.95 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.829 -1.176 . . . . 0.0 111.611 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--N 1.305 -1.344 0 C-N-CA 119.172 -1.011 . . . . 0.0 111.546 -179.868 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.54 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.95 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.512 ' H ' ' HG3' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -80.38 -157.36 0.15 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.131 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -76.85 -53.73 7.52 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.972 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.766 ' O ' HG23 ' A' ' 31' ' ' THR . 63.1 mt-10 -62.4 -24.28 67.31 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.206 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 25' ' ' THR . 37.1 mm-40 -63.87 -29.67 70.83 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.486 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.71 -45.72 74.29 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.696 0.76 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.809 HG21 ' HB3' ' A' ' 59' ' ' LEU . 41.4 t -78.42 -44.19 26.58 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.006 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.766 HG23 ' O ' ' A' ' 27' ' ' GLU . 6.6 p -51.09 -35.39 34.85 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 10.3 mtm -92.52 123.58 35.92 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.549 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -162.86 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.247 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.99 -48.95 36.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.944 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -61.83 -31.25 71.47 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.604 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -77.42 -36.9 52.79 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.222 -0.991 . . . . 0.0 109.928 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 tp -74.49 -42.89 58.19 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.105 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -63.23 -14.36 48.36 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.944 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.09 -32.03 64.72 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.486 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.477 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -99.09 -27.13 13.98 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.226 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.697 HD23 HD12 ' A' ' 44' ' ' LEU . 17.5 mt -54.05 -33.53 57.67 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 119.218 -0.993 . . . . 0.0 111.765 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.489 ' CB ' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -63.61 78.26 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.386 -179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 165.76 -14.61 0.08 OUTLIER Glycine 0 C--N 1.296 -1.679 0 N-CA-C 109.134 -1.586 . . . . 0.0 109.134 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.697 HD12 HD23 ' A' ' 41' ' ' LEU . 22.4 mt -88.93 152.67 21.58 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 46' ' ' LYS . 11.1 t -74.19 155.19 38.62 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.206 -0.998 . . . . 0.0 110.315 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 45' ' ' SER . 1.0 OUTLIER -41.78 -43.24 2.87 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.504 -0.878 . . . . 0.0 111.202 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.69 -48.35 72.36 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.335 -0.946 . . . . 0.0 111.103 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.3 OUTLIER -62.52 -22.62 66.43 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.698 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mm -76.01 -43.15 38.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.749 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -69.55 -40.41 79.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 C-N-CA 118.986 -1.085 . . . . 0.0 109.339 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -57.56 -49.25 76.98 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.878 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.57 ' C ' ' H ' ' A' ' 54' ' ' GLN . 6.0 mp -69.97 -42.31 73.32 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.245 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.436 ' HD2' HH21 ' A' ' 56' ' ' ARG . 0.5 OUTLIER -61.17 5.54 0.06 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.018 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 52' ' ' LEU . 30.2 tt0 -100.32 -76.34 0.56 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.291 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -42.71 -47.84 5.46 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.351 -0.94 . . . . 0.0 110.506 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.436 HH21 ' HD2' ' A' ' 53' ' ' LYS . 4.2 tmm_? -45.72 -36.22 4.84 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.206 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.651 ' CA ' ' HE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -74.82 -34.29 62.32 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.46 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.46 ' N ' ' HG3' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -77.74 -36.97 50.24 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.536 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.809 ' HB3' HG21 ' A' ' 30' ' ' VAL . 20.4 mt -62.53 -21.12 65.3 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.315 -0.954 . . . . 0.0 111.409 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.51 ' HZ2' ' HA ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -90.41 0.97 57.06 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -121.49 -33.32 3.66 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.665 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -65.94 -149.1 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.582 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.21 -27.57 73.6 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.379 -1.391 . . . . 0.0 110.369 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.9 t80 . . . . . 0 C--N 1.308 -1.237 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.949 -179.946 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.571 HD11 HD21 ' A' ' 29' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 121.312 0.577 . . . . 0.0 110.513 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.14 -174.48 3.67 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.437 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -52.43 51.05 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.355 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -56.07 -38.23 70.38 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.861 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -46.88 71.24 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.922 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.571 HD21 HD11 ' A' ' 24' ' ' LEU . 69.7 mt -47.7 -39.67 18.13 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.573 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.428 ' C ' ' N ' ' A' ' 32' ' ' MET . 2.0 t -79.25 -58.95 3.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.915 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.76 -26.66 0.69 Allowed 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.09 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.428 ' N ' ' C ' ' A' ' 30' ' ' VAL . 62.7 mtp -91.05 97.85 11.41 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.923 -1.035 . . . . 0.0 109.993 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.3 m -48.94 -94.27 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 119.821 -0.752 . . . . 0.0 111.58 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.8 t -140.58 -31.59 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.593 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.5 ptt-85 -76.86 -23.76 52.65 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.897 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.34 -31.37 18.95 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.891 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tp -74.35 -39.59 62.69 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.272 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -61.67 -14.84 34.82 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.907 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -89.99 0.04 57.32 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.496 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.42 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -113.38 -29.21 7.3 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.373 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.601 HD12 ' N ' ' A' ' 42' ' ' ARG . 0.2 OUTLIER -84.01 3.36 34.73 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.469 -1.293 . . . . 0.0 112.789 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.601 ' N ' HD12 ' A' ' 41' ' ' LEU . 5.8 mtm180 -50.86 90.68 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.999 -1.08 . . . . 0.0 110.743 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 132.65 0.37 4.44 Favored Glycine 0 N--CA 1.482 1.76 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.8 mt -89.77 124.94 35.08 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 118.719 -1.193 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.6 m -60.36 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.326 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.483 ' O ' HD13 ' A' ' 50' ' ' ILE . 3.3 tmtm? -73.88 -38.21 64.48 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.765 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.733 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 9.9 pm0 -83.15 -11.62 57.75 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.044 -1.062 . . . . 0.0 110.565 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.61 -21.68 21.6 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 119.388 -0.925 . . . . 0.0 110.176 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.513 HG22 HD12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.86 -27.7 15.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 C-N-CA 119.424 -0.911 . . . . 0.0 109.627 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.513 HD12 HG22 ' A' ' 49' ' ' ILE . 1.4 mp -70.29 -33.4 54.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.534 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.422 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 10.8 mm100 -58.03 -43.09 86.58 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.563 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 52' ' ' LEU . 4.4 mm? -69.49 -35.79 75.89 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.681 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HD3' HH21 ' A' ' 56' ' ' ARG . 15.0 mmtp -64.47 -0.52 1.36 Allowed 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.416 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.0 tp60 -86.46 -79.56 0.26 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.963 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -54.08 -38.0 64.83 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.039 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.438 HH21 ' HD3' ' A' ' 53' ' ' LYS . 45.9 ttp85 -59.08 -31.27 68.74 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.013 -1.075 . . . . 0.0 109.724 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -79.43 -28.45 41.71 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.3 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.9 m -71.05 -34.72 71.5 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.294 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.415 ' HB3' HG21 ' A' ' 30' ' ' VAL . 65.3 mt -69.87 -48.61 58.1 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.163 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -63.15 -10.6 15.63 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.644 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -89.4 -62.84 1.39 Allowed 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.395 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -53.36 178.21 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.608 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.409 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -40.09 -32.49 0.39 Allowed Glycine 0 N--CA 1.495 2.599 0 C-N-CA 119.844 -1.17 . . . . 0.0 110.62 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.6 t80 . . . . . 0 C--N 1.306 -1.292 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.429 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.474 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 121.108 0.48 . . . . 0.0 110.438 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -169.47 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.761 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.678 ' HB3' HD11 ' A' ' 59' ' ' LEU . 29.2 m-20 -73.3 -58.04 3.59 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.101 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -52.67 -8.56 0.09 Allowed 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.998 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.532 ' H ' ' C ' ' A' ' 26' ' ' ASP . 2.2 mt-10 -90.57 -32.63 16.21 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.641 -0.824 . . . . 0.0 111.424 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.463 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 92.4 mt -65.45 -23.97 67.06 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.73 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.693 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.9 t -96.63 -59.92 2.93 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.006 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.264 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.463 ' CG2' ' N ' ' A' ' 32' ' ' MET . 14.6 t -41.43 -32.63 0.34 Allowed 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 118.989 -1.084 . . . . 0.0 108.688 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.515 ' SD ' ' O ' ' A' ' 28' ' ' GLU . 14.6 ptm -91.06 119.24 31.05 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.415 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 41.3 t -57.86 -174.85 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.471 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.503 ' N ' ' OG ' ' A' ' 33' ' ' SER . 48.7 t -68.97 -46.18 79.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.255 -0.978 . . . . 0.0 110.672 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -50.69 -46.39 58.78 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.174 -1.01 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.96 -25.36 63.6 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.179 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.464 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -78.94 -49.33 12.98 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.236 -0.986 . . . . 0.0 109.348 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.45 ' ND2' HG12 ' A' ' 34' ' ' VAL . 69.3 m-20 -59.6 -16.98 29.46 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.913 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -78.0 -33.46 51.25 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.361 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.461 ' O ' ' N ' ' A' ' 42' ' ' ARG . 0.7 OUTLIER -89.47 -45.16 9.63 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.364 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.617 HD13 HG23 ' A' ' 49' ' ' ILE . 42.4 mt -46.26 -18.9 0.06 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.703 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' N ' ' O ' ' A' ' 40' ' ' HIS . 1.4 ttp180 -56.35 -10.03 0.82 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.418 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.43 ' N ' ' C ' ' A' ' 41' ' ' LEU . . . -103.76 -1.78 46.17 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.8 mt -110.31 153.51 24.78 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 119.595 -0.842 . . . . 0.0 111.05 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.413 ' O ' ' N ' ' A' ' 48' ' ' GLU . 66.4 m -84.3 154.63 22.83 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.796 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -44.61 -36.33 3.01 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.792 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -80.27 -30.2 38.36 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.589 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 tp10 -81.9 -17.01 48.7 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.529 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.617 HG23 HD13 ' A' ' 41' ' ' LEU . 70.0 mt -82.06 -33.8 11.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.819 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.3 mt -61.21 -59.32 4.46 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.814 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -51.36 -31.14 21.14 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.139 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.429 ' HA ' HD12 ' A' ' 52' ' ' LEU . 9.1 tp -83.66 -16.15 46.16 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.422 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -81.13 -27.35 35.56 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.122 -1.031 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -68.04 -64.25 0.9 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.192 -1.003 . . . . 0.0 110.392 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.55 -54.01 5.2 Favored 'General case' 0 C--N 1.307 -1.274 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.36 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.419 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 10.9 ttt180 -42.5 -35.93 1.2 Allowed 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.95 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.2 tpt85 -72.55 -31.75 65.52 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.416 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 55' ' ' ARG . 17.6 m -67.5 -33.21 74.64 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.094 -1.042 . . . . 0.0 110.295 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.693 ' HB3' HG21 ' A' ' 30' ' ' VAL . 26.7 mt -68.18 -36.26 79.32 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.222 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -57.16 -16.84 8.79 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.42 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -87.91 -53.6 4.66 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.936 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.06 171.15 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.933 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -44.03 -39.28 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 119.365 -1.398 . . . . 0.0 110.004 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.302 -1.457 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.187 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.526 HD23 ' CD2' ' A' ' 29' ' ' LEU . 6.2 tp . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 121.728 0.775 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.97 161.35 0.07 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.193 -1.003 . . . . 0.0 110.958 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.55 ' CB ' HD11 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.15 -41.5 94.65 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.918 179.879 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -59.66 -18.66 43.75 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.818 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.18 -55.1 3.66 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.266 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.526 ' CD2' HD23 ' A' ' 24' ' ' LEU . 55.0 mt -37.78 -47.91 1.05 Allowed 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.983 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.468 ' CG2' HD13 ' A' ' 59' ' ' LEU . 2.3 t -67.27 -57.25 10.49 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.974 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.184 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.62 -27.84 12.51 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 118.577 -1.249 . . . . 0.0 108.854 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.414 ' CE ' HD21 ' A' ' 24' ' ' LEU . 3.2 mtp -91.34 100.3 13.11 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.34 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.1 t -59.02 159.61 6.99 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.135 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' LEU . 41.2 t -45.87 -54.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.99 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -47.63 -41.87 23.02 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 118.643 -1.223 . . . . 0.0 109.997 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -76.82 -23.65 52.78 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.722 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 34' ' ' VAL . 14.6 tp -73.37 -46.06 51.24 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.885 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -49.9 -32.43 14.57 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.059 -1.057 . . . . 0.0 110.788 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.497 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -62.18 -18.54 61.28 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.801 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CD2' HD22 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -108.57 -21.33 12.76 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.873 -0.731 . . . . 0.0 111.152 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.654 HD23 HD12 ' A' ' 44' ' ' LEU . 31.1 mt -70.13 -23.94 63.1 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.299 -0.96 . . . . 0.0 111.695 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -62.2 6.95 0.07 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 118.613 -1.235 . . . . 0.0 110.685 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.605 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -120.53 2.62 12.36 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.654 HD12 HD23 ' A' ' 41' ' ' LEU . 24.1 mt -110.98 155.89 22.04 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 m -77.58 -172.68 2.66 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.333 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.47 ' HG3' ' N ' ' A' ' 47' ' ' GLU . 24.4 pttt -68.19 -49.6 59.79 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.849 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.47 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 13.3 tp10 -69.7 -26.46 64.36 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.745 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -76.91 -19.99 56.75 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.489 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.447 HG12 HD22 ' A' ' 41' ' ' LEU . 9.4 mt -82.25 -43.22 19.22 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 119.214 -0.995 . . . . 0.0 109.936 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 63.3 mt -62.01 -53.48 47.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 C-N-CA 119.423 -0.911 . . . . 0.0 110.28 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -49.74 -45.48 49.43 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.076 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 tp -62.49 -35.58 79.82 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.517 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -65.43 -11.3 41.41 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.248 -0.981 . . . . 0.0 111.253 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -91.0 -45.64 8.6 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.199 -1.0 . . . . 0.0 111.324 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -64.05 -56.53 14.3 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 118.836 -1.146 . . . . 0.0 110.237 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 35.6 ttt-85 -50.37 -30.74 12.94 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.988 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -77.03 -29.93 55.49 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.417 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 m -69.83 -36.24 75.44 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.867 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.55 HD11 ' CB ' ' A' ' 26' ' ' ASP . 41.7 mt -66.53 -49.07 67.71 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.079 -1.048 . . . . 0.0 110.544 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mmmt -53.58 -18.61 3.02 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.612 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -96.13 -47.49 6.04 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.278 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.444 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -56.63 179.59 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.052 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.444 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -42.59 -43.12 4.92 Favored Glycine 0 N--CA 1.493 2.467 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.661 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--N 1.303 -1.421 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.91 -179.917 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.456 HD11 ' SD ' ' A' ' 32' ' ' MET . 5.1 tp . . . . . 0 C--O 1.216 -0.684 0 CA-C-O 122.071 0.939 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.407 ' C ' ' O ' ' A' ' 24' ' ' LEU . 1.2 p -41.97 152.81 0.07 Allowed 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.727 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.609 ' CG ' HH21 ' A' ' 55' ' ' ARG . 10.1 m-20 -52.28 -38.99 59.88 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 118.783 -1.167 . . . . 0.0 110.279 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -62.69 -18.24 62.08 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 119.467 -0.893 . . . . 0.0 111.738 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -90.76 -48.71 6.87 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.876 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.545 HD22 ' HB2' ' A' ' 56' ' ' ARG . 9.7 mt -39.98 -46.99 2.18 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.565 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.492 HG23 HD13 ' A' ' 59' ' ' LEU . 4.2 t -69.33 -61.13 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.079 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.028 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.401 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -46.03 -22.73 0.23 Allowed 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 118.888 -1.125 . . . . 0.0 109.576 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.467 ' N ' ' C ' ' A' ' 30' ' ' VAL . 28.8 mtp -91.17 92.96 8.9 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.453 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 37' ' ' LEU . 1.6 t -53.01 176.25 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.889 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 t -53.69 -62.81 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.821 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.424 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 21.1 ptt180 -50.71 -33.18 21.82 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 118.942 -1.103 . . . . 0.0 110.024 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 21.8 mt-10 -78.59 -31.83 47.38 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.614 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.547 HD22 ' HD3' ' A' ' 56' ' ' ARG . 15.9 tp -73.86 -45.26 52.14 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.62 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -54.02 -32.56 54.7 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 118.997 -1.081 . . . . 0.0 110.225 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -27.32 68.28 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.662 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.33 -30.04 14.72 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.653 -0.819 . . . . 0.0 110.757 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 44' ' ' LEU . 44.3 mt -72.46 -32.98 66.7 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.2 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -52.82 88.59 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.112 -1.035 . . . . 0.0 110.179 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.557 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 142.03 -15.08 2.59 Favored Glycine 0 C--N 1.297 -1.606 0 N-CA-C 109.309 -1.517 . . . . 0.0 109.309 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.89 HD12 HD23 ' A' ' 41' ' ' LEU . 17.6 mt -84.95 169.4 14.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.679 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.75 154.05 19.82 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.7 tptt -45.23 -58.34 3.33 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.082 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 48' ' ' GLU . 8.4 pt-20 -57.29 -26.45 60.89 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.454 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 15.6 tp10 -83.87 -25.7 30.04 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.089 -1.044 . . . . 0.0 109.878 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.534 HG13 HD22 ' A' ' 41' ' ' LEU . 1.1 mp -71.38 -37.57 65.59 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.2 mt -60.13 -60.14 3.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.972 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -48.08 -36.96 14.06 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.47 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.458 ' CD1' ' CD1' ' A' ' 44' ' ' LEU . 16.3 mt -85.12 -19.62 31.56 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.132 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -83.99 -3.47 58.02 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.279 -0.969 . . . . 0.0 110.712 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -104.35 -62.35 1.33 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.097 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.609 HH21 ' CG ' ' A' ' 26' ' ' ASP . 3.9 ttt180 -44.8 -54.2 6.61 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.843 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.547 ' HD3' HD22 ' A' ' 37' ' ' LEU . 53.2 ttp85 -46.92 -35.11 6.11 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.076 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.3 ttt-85 -76.11 -34.15 59.48 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.274 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -62.78 -37.42 86.58 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.785 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.492 HD13 HG23 ' A' ' 30' ' ' VAL . 27.9 mt -66.03 -46.3 78.36 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.29 -0.964 . . . . 0.0 110.604 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -55.0 -17.47 3.81 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.242 -0.983 . . . . 0.0 110.566 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -95.26 -40.38 9.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.958 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.585 ' CG ' ' H ' ' A' ' 63' ' ' GLY . 40.0 ttp85 -64.14 178.74 0.64 Allowed 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.989 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.585 ' H ' ' CG ' ' A' ' 62' ' ' ARG . . . -44.09 -39.1 5.07 Favored Glycine 0 N--CA 1.492 2.394 0 C-N-CA 119.444 -1.36 . . . . 0.0 110.114 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--N 1.304 -1.395 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.508 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.403 0.62 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 p -69.54 156.29 39.13 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.051 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.31 -35.6 72.11 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.489 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.493 ' H ' ' CD ' ' A' ' 27' ' ' GLU . 3.9 mp0 -63.6 -27.04 68.96 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.282 -0.967 . . . . 0.0 110.506 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' VAL . 3.0 mt-10 -78.13 -49.45 13.86 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.059 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 29' ' ' LEU . 12.1 mt -37.41 -24.85 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.943 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -99.08 -59.06 3.47 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.345 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.56 -45.0 9.18 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.761 -1.176 . . . . 0.0 109.119 179.908 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.435 ' O ' ' CG ' ' A' ' 32' ' ' MET . 2.7 ptt? -92.31 120.64 33.04 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.111 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.7 p -77.31 -165.55 0.6 Allowed 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.636 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.4 t -56.16 -49.83 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.789 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.419 ' H ' ' HG2' ' A' ' 35' ' ' ARG . 21.5 mmm180 -44.37 -51.49 8.51 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.248 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 36' ' ' GLU . 2.6 mp0 -71.97 -30.12 64.94 Favored 'General case' 0 C--N 1.295 -1.799 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.452 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.402 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 2.6 tt -65.82 -45.35 82.62 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.959 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -58.71 -14.94 9.84 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.056 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -15.51 44.26 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.788 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.567 ' NE2' HD13 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -99.25 -46.3 5.58 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.525 -179.835 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.711 HD12 ' N ' ' A' ' 42' ' ' ARG . 0.3 OUTLIER -66.55 5.63 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.496 -179.861 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.711 ' N ' HD12 ' A' ' 41' ' ' LEU . 9.8 mtp85 -44.9 99.24 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.733 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 107.42 8.62 30.57 Favored Glycine 0 N--CA 1.483 1.813 0 C-N-CA 119.926 -1.13 . . . . 0.0 111.832 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.576 HD12 ' CB ' ' A' ' 41' ' ' LEU . 19.6 mt -84.21 151.4 24.86 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 117.437 -1.705 . . . . 0.0 110.823 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.449 ' OG ' ' OE2' ' A' ' 47' ' ' GLU . 33.7 t -78.54 171.05 15.68 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.631 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -59.87 -40.98 90.51 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.785 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.725 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -79.49 -16.98 55.12 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.707 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.565 ' HG2' HD22 ' A' ' 44' ' ' LEU . 18.2 tt0 -89.73 -20.34 23.69 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.298 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 48.6 mt -82.89 -35.36 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.593 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.273 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.239 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -52.76 -50.47 63.43 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.09 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.567 HD13 ' NE2' ' A' ' 40' ' ' HIS . 27.8 mt -67.61 -20.07 65.31 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.917 -1.113 . . . . 0.0 110.387 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.26 -19.94 38.58 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.658 -0.817 . . . . 0.0 110.436 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -76.62 -59.1 2.91 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.652 -0.819 . . . . 0.0 111.034 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.9 mmt-85 -55.57 -46.86 77.13 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.356 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.455 ' NH2' ' HE3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -51.28 -35.66 38.53 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.804 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.66 -35.77 70.44 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.717 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 17.1 m -58.88 -44.31 91.12 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.069 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.404 HD13 ' CG2' ' A' ' 30' ' ' VAL . 44.2 mt -65.95 -50.46 64.29 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.8 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.455 ' HE3' ' NH2' ' A' ' 56' ' ' ARG . 0.3 OUTLIER -56.63 -12.15 1.68 Allowed 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.735 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -96.53 -52.32 3.99 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.545 -0.862 . . . . 0.0 111.212 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.421 HH21 ' HB3' ' A' ' 62' ' ' ARG . 26.4 mtp85 -57.43 -171.77 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.548 -0.861 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.6 -46.14 5.71 Favored Glycine 0 N--CA 1.492 2.37 0 C-N-CA 119.592 -1.289 . . . . 0.0 110.43 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.394 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.379 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.463 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 121.384 0.612 . . . . 0.0 110.184 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -170.51 0.54 Allowed 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.711 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.525 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -80.5 -53.84 6.21 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.234 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 64' ' ' TYR . 14.2 mt-10 -58.59 -13.75 6.51 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 118.917 -1.113 . . . . 0.0 109.446 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.411 ' C ' ' N ' ' A' ' 30' ' ' VAL . 28.4 mm-40 -79.79 -49.03 12.6 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.523 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 28' ' ' GLU . 46.5 mt -41.61 -30.41 0.22 Allowed 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.117 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.507 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -83.33 -61.86 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.338 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.68 -29.92 2.11 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.615 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 3.1 mtp -90.7 95.57 10.21 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.615 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 33.2 t -44.04 146.83 0.57 Allowed 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.712 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.465 ' H ' HG23 ' A' ' 34' ' ' VAL . 2.0 t -41.37 -47.99 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.936 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -53.08 -41.82 65.27 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.902 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.524 ' OE1' ' N ' ' A' ' 36' ' ' GLU . 1.3 mp0 -73.73 -22.01 60.03 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 119.141 -1.024 . . . . 0.0 109.584 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.438 ' C ' ' N ' ' A' ' 39' ' ' GLN . 13.4 tp -79.31 -51.28 9.65 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.126 -1.03 . . . . 0.0 108.908 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -53.26 -19.26 3.01 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.025 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.438 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -68.91 -42.76 76.42 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.52 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.455 ' CG ' ' N ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -75.3 -47.04 29.69 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.069 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 1.009 HD23 HD12 ' A' ' 44' ' ' LEU . 27.9 mt -42.66 -29.68 0.32 Allowed 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.087 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -45.96 95.62 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.577 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 133.46 -13.94 4.82 Favored Glycine 0 N--CA 1.484 1.838 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 1.009 HD12 HD23 ' A' ' 41' ' ' LEU . 16.4 mt -91.44 127.77 37.02 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.069 -1.052 . . . . 0.0 110.818 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.1 m -47.87 165.01 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.524 -0.871 . . . . 0.0 110.836 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.561 ' O ' HD13 ' A' ' 50' ' ' ILE . 7.3 pttm -61.26 -20.52 62.95 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.001 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -85.79 -32.76 21.63 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.859 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.06 -13.35 59.82 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.079 -1.049 . . . . 0.0 109.984 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mt -81.78 -36.6 14.47 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.023 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 46' ' ' LYS . 1.5 mp -69.78 -33.75 57.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.69 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -64.62 -27.47 68.96 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 mp -93.53 -27.3 16.72 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.257 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -71.91 5.66 2.5 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.302 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -102.56 -64.51 1.06 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 119.831 -0.747 . . . . 0.0 111.204 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 58' ' ' THR . 38.2 mtt85 -50.86 -50.03 57.72 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.058 -1.057 . . . . 0.0 110.994 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.423 HH21 ' CG2' ' A' ' 34' ' ' VAL . 0.8 OUTLIER -48.13 -33.24 7.99 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 118.971 -1.092 . . . . 0.0 110.542 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -79.3 -22.55 44.47 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.867 -1.133 . . . . 0.0 110.334 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.436 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.8 m -79.59 -42.28 25.33 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.258 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.507 HD13 ' CG2' ' A' ' 30' ' ' VAL . 27.0 mt -58.84 -54.6 45.24 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.555 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -45.35 -22.18 0.12 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.264 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.412 ' N ' ' C ' ' A' ' 59' ' ' LEU . 27.2 t-20 -100.31 -45.9 5.44 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 119.637 -0.825 . . . . 0.0 111.906 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.505 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 11.0 ttt180 -53.37 176.53 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.23 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.505 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.8 -33.3 1.07 Allowed Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.685 -1.245 . . . . 0.0 110.318 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 27' ' ' GLU . 3.0 t80 . . . . . 0 C--N 1.306 -1.298 0 C-N-CA 119.316 -0.953 . . . . 0.0 110.319 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.415 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 121.417 0.627 . . . . 0.0 110.112 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.1 p -59.27 178.18 0.15 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.244 -0.982 . . . . 0.0 110.909 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -69.37 -33.72 73.47 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.09 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.613 ' N ' ' CD ' ' A' ' 27' ' ' GLU . 4.0 mp0 -63.5 -53.84 45.71 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.8 -1.16 . . . . 0.0 109.318 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.471 ' HB3' ' SD ' ' A' ' 32' ' ' MET . 21.9 mt-10 -45.51 -48.68 14.13 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.368 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.509 HD22 ' HB2' ' A' ' 56' ' ' ARG . 6.5 mt -44.91 -35.35 2.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.943 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.556 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.3 t -99.87 -53.68 7.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.112 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.77 -26.16 0.23 Allowed 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.661 -1.216 . . . . 0.0 109.396 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.471 ' SD ' ' HB3' ' A' ' 28' ' ' GLU . 28.5 mtp -90.39 104.35 16.94 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.629 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 13.8 t -47.51 -96.16 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.24 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.419 ' N ' ' OG ' ' A' ' 33' ' ' SER . 47.8 t -138.04 -30.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.033 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -71.82 -52.77 15.84 Favored 'General case' 0 C--N 1.3 -1.578 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.403 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -66.2 -30.56 71.04 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.169 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD11 ' CD ' ' A' ' 56' ' ' ARG . 1.3 tt -73.99 -51.44 15.92 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -54.72 -16.8 2.78 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.8 OUTLIER -77.03 -39.22 50.97 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.337 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -38.97 34.94 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.92 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.593 HD23 HD12 ' A' ' 44' ' ' LEU . 16.2 mt -48.14 -30.4 4.53 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.024 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.523 ' HA ' ' HE ' ' A' ' 42' ' ' ARG . 15.0 mmm-85 -58.61 86.13 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.823 -1.151 . . . . 0.0 110.001 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 152.06 -13.11 0.73 Allowed Glycine 0 C--N 1.292 -1.893 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.593 HD12 HD23 ' A' ' 41' ' ' LEU . 13.6 mt -94.89 123.14 38.19 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.575 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 48' ' ' GLU . 94.0 p -66.86 155.61 37.91 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.338 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -43.82 -29.27 0.52 Allowed 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.67 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -83.56 -31.64 26.26 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.623 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 45' ' ' SER . 0.0 OUTLIER -81.71 -16.86 49.83 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.503 HG12 HD22 ' A' ' 41' ' ' LEU . 21.9 mt -81.63 -35.97 14.13 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.044 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -72.85 -50.06 35.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.657 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -65.89 -15.51 63.01 Favored 'General case' 0 C--N 1.296 -1.72 0 C-N-CA 119.291 -0.964 . . . . 0.0 110.297 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.848 HD13 ' C ' ' A' ' 52' ' ' LEU . 3.0 tm? -101.02 -51.97 3.4 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.188 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.445 ' N ' HD13 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -56.5 -6.46 0.3 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.62 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 52' ' ' LEU . 42.9 tt0 -72.02 -71.65 0.27 Allowed 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.46 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.3 -51.49 6.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.022 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.509 ' HB2' HD22 ' A' ' 29' ' ' LEU . 64.7 ttp85 -42.58 -36.82 1.48 Allowed 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.187 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.1 ttm-85 -72.52 -31.4 65.3 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.384 -0.926 . . . . 0.0 110.544 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.524 ' N ' ' O ' ' A' ' 55' ' ' ARG . 21.9 m -67.98 -33.26 74.31 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.767 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 30' ' ' VAL . 45.6 mt -66.03 -49.75 66.61 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.122 -1.031 . . . . 0.0 110.416 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.3 mmtt -52.48 -15.67 0.72 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -93.33 -50.48 5.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.563 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -51.17 171.72 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.153 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.66 -29.88 0.83 Allowed Glycine 0 N--CA 1.492 2.419 0 C-N-CA 119.677 -1.249 . . . . 0.0 110.662 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--N 1.302 -1.475 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.736 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.519 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.3 0.572 . . . . 0.0 110.575 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.467 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -83.64 176.06 9.27 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.287 -0.965 . . . . 0.0 110.458 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.33 -47.22 79.21 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.374 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -43.02 97.13 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 118.859 -1.136 . . . . 0.0 109.355 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HB2' ' N ' ' A' ' 25' ' ' THR . 12.7 mm-40 -55.11 -44.74 75.23 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.649 -0.821 . . . . 0.0 111.367 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 14.2 mt -47.53 -34.02 7.09 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.422 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.707 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.7 t -94.13 -56.35 5.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 119.555 -0.858 . . . . 0.0 111.828 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.96 -29.66 0.87 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.002 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.481 ' SD ' ' HA ' ' A' ' 29' ' ' LEU . 12.8 ptm -92.42 120.74 33.22 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.266 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 78.1 p -63.87 -145.16 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.995 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.8 t -92.69 -42.69 13.44 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.966 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -51.6 -45.23 63.11 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.949 -1.101 . . . . 0.0 110.117 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -73.23 -28.18 62.02 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.947 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.518 HD21 HH22 ' A' ' 56' ' ' ARG . 9.2 tp -72.68 -43.7 62.76 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.628 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 -56.27 -18.04 9.36 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.01 -1.076 . . . . 0.0 109.958 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -78.98 -26.72 43.36 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.388 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.4 ' O ' ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -96.7 -36.97 10.5 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.692 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 43' ' ' GLY . 12.1 mt -42.28 -36.82 1.33 Allowed 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.016 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -59.46 84.37 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 119.054 -1.058 . . . . 0.0 110.053 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 156.76 -14.48 0.34 Allowed Glycine 0 C--N 1.293 -1.812 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.602 ' CD1' HD22 ' A' ' 52' ' ' LEU . 5.1 mt -96.94 129.23 44.42 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.64 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 48' ' ' GLU . 2.4 t -73.35 157.72 36.42 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.233 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -44.33 -40.0 5.0 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.228 -0.989 . . . . 0.0 110.767 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.62 -14.06 57.18 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.634 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.513 ' N ' ' O ' ' A' ' 45' ' ' SER . 25.9 tp10 -90.46 -25.25 20.42 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.462 -0.895 . . . . 0.0 109.832 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 32.1 mt -78.42 -22.36 13.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.091 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.463 HG22 ' N ' ' A' ' 51' ' ' GLN . 9.9 mt -71.74 -62.21 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.318 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.463 ' N ' HG22 ' A' ' 50' ' ' ILE . 10.7 pt20 -50.64 -31.85 17.33 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.602 HD22 ' CD1' ' A' ' 44' ' ' LEU . 2.1 tp -75.15 -39.4 60.43 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.613 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.453 ' HD3' ' NH2' ' A' ' 56' ' ' ARG . 37.0 mmtt -62.08 -3.55 1.3 Allowed 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.482 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.433 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.7 tt0 -88.09 -75.09 0.43 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.957 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.474 ' HE ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -49.14 -45.82 44.24 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.466 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.518 HH22 HD21 ' A' ' 37' ' ' LEU . 5.1 tmm_? -53.41 -38.87 63.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.951 -1.1 . . . . 0.0 109.59 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -74.64 -34.9 62.85 Favored 'General case' 0 C--N 1.304 -1.376 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.286 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -61.18 -34.51 75.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 119.026 -1.07 . . . . 0.0 110.155 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.707 ' HB3' HG21 ' A' ' 30' ' ' VAL . 37.8 mt -69.05 -34.27 74.9 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.354 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -70.73 -9.7 57.82 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.581 -0.848 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.73 -56.99 2.34 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.665 -0.814 . . . . 0.0 111.674 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 ttt-85 -52.72 176.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -40.89 -30.96 0.4 Allowed Glycine 0 N--CA 1.494 2.541 0 C-N-CA 119.752 -1.213 . . . . 0.0 110.408 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 C--N 1.303 -1.428 0 C-N-CA 119.339 -0.944 . . . . 0.0 110.358 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.508 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 121.091 0.472 . . . . 0.0 110.407 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.419 ' H ' HG23 ' A' ' 25' ' ' THR . 44.7 p -55.81 179.87 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.881 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -71.53 -32.32 68.02 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 118.984 -1.087 . . . . 0.0 110.311 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.431 ' HG3' ' H ' ' A' ' 27' ' ' GLU . 19.0 mt-10 -62.43 -20.73 64.79 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -87.07 -41.71 13.62 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.119 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 56' ' ' ARG . 6.5 mt -41.4 -34.84 0.58 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.28 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.547 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -85.4 -61.7 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.711 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.923 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -26.93 0.82 Allowed 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.001 -1.08 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.5 mtp -90.3 92.1 8.78 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.979 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 34' ' ' VAL . 74.6 p -46.99 162.78 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.404 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 34' ' ' VAL . 21.5 t -39.9 -57.61 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.152 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.64 30.23 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.432 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -60.19 -39.36 86.26 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.172 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.4 -49.43 60.09 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.521 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.24 -14.22 2.66 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.545 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -84.17 -33.52 24.19 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.394 -0.923 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.531 ' O ' ' N ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -85.76 -36.59 20.04 Favored 'General case' 0 C--N 1.305 -1.35 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.873 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.708 HD23 HD12 ' A' ' 44' ' ' LEU . 32.8 mt -47.13 -12.14 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.209 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 40' ' ' HIS . 10.7 mmm180 -70.86 31.81 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.512 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.607 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -152.49 4.31 0.4 Allowed Glycine 0 C--N 1.294 -1.791 0 N-CA-C 109.261 -1.535 . . . . 0.0 109.261 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.708 HD12 HD23 ' A' ' 41' ' ' LEU . 15.2 mt -106.04 165.64 11.07 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.46 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.448 ' O ' ' N ' ' A' ' 49' ' ' ILE . 1.2 m -96.36 156.32 16.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.749 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -42.91 -46.04 5.21 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.124 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -71.13 -36.58 72.17 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -79.91 -11.34 59.81 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.093 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.448 ' N ' ' O ' ' A' ' 45' ' ' SER . 45.6 mt -90.49 -40.95 13.18 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.693 -0.803 . . . . 0.0 110.675 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -58.13 -56.93 12.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.124 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -51.05 -29.06 11.75 Favored 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.776 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.416 HD22 ' CD1' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -78.63 -35.25 45.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.937 -1.105 . . . . 0.0 111.343 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.4 mttt -59.3 -21.67 60.05 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.406 -0.918 . . . . 0.0 111.526 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.421 ' O ' ' N ' ' A' ' 57' ' ' ARG . 8.7 tt0 -98.88 -69.8 0.75 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.524 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.2 OUTLIER -40.33 -50.9 2.81 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.214 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.535 ' HB2' HD22 ' A' ' 29' ' ' LEU . 1.0 OUTLIER -46.95 -36.03 7.2 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 118.79 -1.164 . . . . 0.0 109.927 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.447 ' HD2' ' NH1' ' A' ' 56' ' ' ARG . 5.4 tpt85 -77.01 -18.94 57.85 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.474 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.522 ' N ' ' O ' ' A' ' 55' ' ' ARG . 3.3 m -82.64 -34.62 27.46 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.02 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.547 HD13 ' CG2' ' A' ' 30' ' ' VAL . 15.3 mt -51.95 -51.81 54.54 Favored 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.895 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -49.14 -17.97 0.28 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.992 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 59' ' ' LEU . 66.1 m-20 -106.14 -35.24 7.28 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.007 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.498 ' NE ' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -62.45 -169.64 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.505 -0.878 . . . . 0.0 110.948 -179.969 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.498 ' H ' ' NE ' ' A' ' 62' ' ' ARG . . . -43.86 -56.36 5.14 Favored Glycine 0 N--CA 1.491 2.326 0 C-N-CA 119.504 -1.331 . . . . 0.0 110.696 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.486 1.347 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.192 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.492 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.391 0.615 . . . . 0.0 109.98 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.7 p -63.64 -178.4 0.29 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.735 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -75.26 -36.13 61.3 Favored 'General case' 0 C--N 1.3 -1.587 0 C-N-CA 119.306 -0.957 . . . . 0.0 110.286 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.625 ' OE1' ' CE1' ' A' ' 64' ' ' TYR . 18.2 mm-40 -68.91 -6.87 29.99 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.935 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -90.34 -49.98 6.22 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.444 HD23 HD13 ' A' ' 37' ' ' LEU . 62.5 mt -43.05 -37.73 2.05 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.451 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.51 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.7 t -76.96 -55.33 11.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.177 -1.009 . . . . 0.0 110.525 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -48.52 -29.35 4.1 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.467 -1.293 . . . . 0.0 108.648 179.805 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 58.3 mtp -90.84 104.22 16.83 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.159 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m -46.65 -92.78 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.827 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.89 -30.4 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 C-N-CA 119.586 -0.846 . . . . 0.0 109.846 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -74.8 -36.68 62.48 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.308 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.92 -26.43 48.99 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.473 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.444 HD13 HD23 ' A' ' 29' ' ' LEU . 23.1 tp -79.2 -46.23 18.29 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.525 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -68.05 -8.54 38.66 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.664 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.532 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 1.8 mm-40 -80.83 -24.9 38.12 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.033 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.47 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -104.87 -30.11 10.07 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.369 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.624 HD23 HD12 ' A' ' 44' ' ' LEU . 17.2 mt -57.93 -37.33 73.88 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.585 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -55.51 -0.27 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.813 -1.155 . . . . 0.0 110.936 -179.86 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.613 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -100.37 -9.87 46.29 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.624 HD12 HD23 ' A' ' 41' ' ' LEU . 67.0 mt -98.5 178.11 5.13 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.647 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.612 ' OG ' ' N ' ' A' ' 46' ' ' LYS . 28.7 t -79.51 -170.08 2.18 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.319 -0.952 . . . . 0.0 110.249 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.612 ' N ' ' OG ' ' A' ' 45' ' ' SER . 8.7 mtpp -79.78 -38.62 32.72 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.768 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.15 -25.17 51.69 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.462 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.437 ' O ' HD23 ' A' ' 52' ' ' LEU . 46.3 mm-40 -78.41 -17.2 56.73 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.369 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.413 HD12 ' O ' ' A' ' 45' ' ' SER . 35.4 mt -86.12 -27.67 6.15 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.345 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.896 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.5 HG22 ' N ' ' A' ' 51' ' ' GLN . 12.4 mt -66.16 -63.86 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.5 ' N ' HG22 ' A' ' 50' ' ' ILE . 75.0 mt-30 -57.43 -27.92 62.83 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.54 -0.864 . . . . 0.0 111.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 48' ' ' GLU . 3.4 mm? -76.89 -28.65 55.43 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.925 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -37.68 68.59 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.587 -0.845 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -79.04 -38.4 36.64 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.196 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 58' ' ' THR . 7.1 ttt180 -56.17 -55.68 30.13 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.484 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.491 ' C ' ' CD ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -46.25 -41.34 12.82 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 118.946 -1.102 . . . . 0.0 109.526 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -66.63 -34.27 77.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.555 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.411 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.1 m -65.96 -38.33 88.29 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.544 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.51 HD13 ' CG2' ' A' ' 30' ' ' VAL . 17.2 mt -58.14 -48.93 78.74 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.067 -1.053 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.83 -23.61 0.29 Allowed 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.254 -0.978 . . . . 0.0 110.56 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 59' ' ' LEU . 2.1 t30 -98.87 -37.33 9.47 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.167 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.7 ttt-85 -59.51 178.61 0.14 Allowed 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.976 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.89 -45.46 5.9 Favored Glycine 0 N--CA 1.493 2.439 0 C-N-CA 119.624 -1.274 . . . . 0.0 110.258 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.625 ' CE1' ' OE1' ' A' ' 27' ' ' GLU . 5.1 t80 . . . . . 0 C--N 1.302 -1.492 0 C-N-CA 119.581 -0.848 . . . . 0.0 110.451 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.525 HD11 ' SD ' ' A' ' 32' ' ' MET . 11.0 tp . . . . . 0 C--O 1.215 -0.711 0 CA-C-O 121.356 0.598 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.2 p -62.94 177.99 0.51 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 118.557 -1.257 . . . . 0.0 110.066 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.22 -28.06 59.8 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.359 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.63 -18.09 63.57 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.94 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -90.2 -42.55 10.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.394 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.483 HD23 ' HA ' ' A' ' 29' ' ' LEU . 14.4 mt -42.62 -35.75 1.19 Allowed 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.065 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 30' ' ' VAL . 1.6 t -82.06 -61.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.464 -0.894 . . . . 0.0 110.873 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.33 -24.3 0.47 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 118.863 -1.135 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.525 ' SD ' HD11 ' A' ' 24' ' ' LEU . 15.0 mtp -90.31 91.41 8.48 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.827 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 40.4 t -47.64 164.62 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.95 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.3 t -41.63 -56.57 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.095 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' HE ' ' HB2' ' A' ' 35' ' ' ARG . 11.0 tpp180 -52.63 -46.79 67.24 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.474 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.97 -43.37 98.97 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.146 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.78 -45.7 77.62 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.869 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -57.86 -22.84 50.1 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.193 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.3 -24.93 59.3 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.756 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.477 ' CD2' HD22 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -98.07 -19.43 17.97 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.589 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.652 ' C ' ' H ' ' A' ' 43' ' ' GLY . 30.9 mt -76.4 -23.25 54.03 Favored 'General case' 0 C--N 1.304 -1.412 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.702 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 -69.28 27.96 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.701 -1.2 . . . . 0.0 110.66 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.652 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -139.44 -3.08 1.66 Allowed Glycine 0 N--CA 1.479 1.555 0 N-CA-C 109.028 -1.629 . . . . 0.0 109.028 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.45 ' CD1' HD12 ' A' ' 52' ' ' LEU . 22.4 mt -103.03 178.75 4.47 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.991 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.4 t -90.88 153.4 20.23 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.658 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -48.73 -42.48 35.4 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.043 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.505 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 1.8 mp0 -75.85 -23.93 55.73 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.231 -0.988 . . . . 0.0 110.773 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.438 ' HG3' HD13 ' A' ' 44' ' ' LEU . 25.1 tp10 -82.12 -19.37 40.22 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.017 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.486 HG22 HD12 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -76.06 -32.16 22.71 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 C-N-CA 119.536 -0.865 . . . . 0.0 109.696 179.941 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.486 HD12 HG22 ' A' ' 49' ' ' ILE . 1.5 mp -70.3 -32.61 51.12 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 C-N-CA 119.659 -0.816 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -65.99 -39.04 89.98 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.043 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 44' ' ' LEU . 93.1 mt -86.33 -34.12 20.38 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.418 -0.913 . . . . 0.0 111.253 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -62.7 -12.99 27.15 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.237 -0.985 . . . . 0.0 110.791 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.04 -68.64 0.79 Allowed 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -48.47 -47.96 38.12 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.03 -1.068 . . . . 0.0 110.386 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -47.75 -42.91 26.57 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.073 -1.051 . . . . 0.0 109.959 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -68.9 -29.53 67.82 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.284 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -66.05 -37.69 86.48 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.3 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.439 HD13 ' CG2' ' A' ' 30' ' ' VAL . 41.4 mt -66.27 -53.21 39.52 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.178 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -57.6 -14.01 4.7 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.446 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -90.13 -62.02 1.56 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.423 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 63' ' ' GLY . 10.1 ptp180 -52.4 176.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.729 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -37.8 -42.7 1.11 Allowed Glycine 0 N--CA 1.498 2.793 0 C-N-CA 120.182 -1.009 . . . . 0.0 111.009 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.304 -1.41 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.49 179.974 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 24' ' ' LEU . 13.4 tp . . . . . 0 CA--C 1.491 -1.299 0 CA-C-O 121.69 0.757 . . . . 0.0 112.109 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -52.21 171.31 0.05 Allowed 'General case' 0 C--N 1.283 -2.291 0 C-N-CA 118.714 -1.194 . . . . 0.0 110.637 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.18 -28.37 64.19 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.338 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -71.24 -11.55 60.98 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.73 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -89.37 -45.21 9.64 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.21 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.1 mt -41.27 -31.55 0.23 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.615 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.437 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.4 t -85.75 -61.27 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.169 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -27.75 1.16 Allowed 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 118.934 -1.106 . . . . 0.0 110.247 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.9 mtp -90.24 91.9 8.7 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.0 t -51.04 171.2 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.829 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 77.3 t -46.09 -64.41 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 119.434 -0.907 . . . . 0.0 110.98 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.413 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 27.2 ptt-85 -47.38 -42.16 21.26 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.933 -1.107 . . . . 0.0 110.207 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 35' ' ' ARG . 9.3 tt0 -68.94 -40.01 79.21 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.875 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.465 HD22 ' CD ' ' A' ' 56' ' ' ARG . 15.1 tp -67.52 -43.1 81.64 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.446 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -49.49 -34.68 17.64 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.015 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -41.17 92.67 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.27 -0.972 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.03 -38.02 57.7 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.357 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.916 HD23 HD12 ' A' ' 44' ' ' LEU . 41.6 mt -62.8 -19.31 63.93 Favored 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.643 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.85 77.89 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.149 -1.02 . . . . 0.0 110.124 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 153.84 -10.11 0.48 Allowed Glycine 0 C--N 1.295 -1.708 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.916 HD12 HD23 ' A' ' 41' ' ' LEU . 15.2 mt -92.71 151.25 20.17 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.692 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -75.37 152.3 38.09 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.779 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.506 ' HA ' HD12 ' A' ' 49' ' ' ILE . 14.6 ptpt -45.17 -41.88 8.58 Favored 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.909 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.449 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 11.5 mt-10 -75.9 -27.68 57.79 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.572 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -80.19 -19.09 47.88 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.092 -1.043 . . . . 0.0 109.91 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.537 HG23 HD13 ' A' ' 41' ' ' LEU . 8.6 mt -78.99 -33.17 15.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 C-N-CA 119.416 -0.914 . . . . 0.0 109.608 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.453 HG22 ' N ' ' A' ' 51' ' ' GLN . 12.4 mt -62.35 -62.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.419 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.453 ' N ' HG22 ' A' ' 50' ' ' ILE . 71.0 mt-30 -48.03 -30.32 4.28 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.63 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.499 ' HA ' HD22 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -68.36 -34.04 75.37 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.471 179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HD3' ' HE ' ' A' ' 56' ' ' ARG . 24.6 mmtp -77.95 -5.2 50.43 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.728 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.456 ' O ' ' N ' ' A' ' 57' ' ' ARG . 48.5 tt0 -76.03 -85.18 0.05 Allowed 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.348 -0.941 . . . . 0.0 111.031 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.521 ' H ' ' HD2' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -45.35 -37.77 5.23 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 119.062 -1.055 . . . . 0.0 110.497 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.538 ' HE ' ' HD3' ' A' ' 53' ' ' LYS . 42.5 ttp85 -57.87 -31.37 66.63 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.113 -1.035 . . . . 0.0 109.719 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' GLN . 22.1 ttp180 -75.91 -30.75 58.88 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.265 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -66.85 -37.73 85.02 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.527 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.437 HD13 ' CG2' ' A' ' 30' ' ' VAL . 39.6 mt -67.55 -51.87 45.56 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.578 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.406 ' HB3' ' HZ3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.31 -14.85 5.0 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.221 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -88.41 -63.62 1.27 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.426 -0.91 . . . . 0.0 112.351 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 64' ' ' TYR . 17.7 ptm180 -48.81 169.5 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.508 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -38.16 -31.24 0.1 OUTLIER Glycine 0 N--CA 1.497 2.75 0 C-N-CA 120.035 -1.079 . . . . 0.0 110.542 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.445 ' N ' ' O ' ' A' ' 62' ' ' ARG . 3.9 t80 . . . . . 0 C--N 1.302 -1.464 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.067 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.427 ' HA ' HD12 ' A' ' 24' ' ' LEU . 1.1 tp . . . . . 0 C--O 1.217 -0.658 0 CA-C-O 121.919 0.866 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.496 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -70.95 174.96 5.52 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.104 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -52.09 -50.33 61.82 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.161 -1.015 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.609 ' H ' ' CD ' ' A' ' 27' ' ' GLU . 1.7 mp0 -65.69 -29.31 69.84 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.283 -0.967 . . . . 0.0 111.1 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.496 ' HB2' ' N ' ' A' ' 25' ' ' THR . 8.8 mt-10 -72.42 -35.85 68.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.203 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 29' ' ' LEU . 49.0 mt -59.76 -44.58 93.79 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.422 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.477 ' C ' ' N ' ' A' ' 32' ' ' MET . 3.0 t -71.44 -49.66 45.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.83 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.285 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.46 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.47 -28.57 0.37 Allowed 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.076 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.477 ' N ' ' C ' ' A' ' 30' ' ' VAL . 30.4 mtp -92.4 113.13 25.32 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.577 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.7 t -49.23 -95.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.744 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.426 HG12 ' ND2' ' A' ' 38' ' ' ASN . 6.6 t -147.06 -27.49 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.834 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.4 ' HG2' ' H ' ' A' ' 35' ' ' ARG . 9.2 ptt-85 -74.03 -40.27 62.98 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.422 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -71.98 -31.29 66.11 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.279 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 20.4 tp -72.53 -51.64 19.07 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.466 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.426 ' ND2' HG12 ' A' ' 34' ' ' VAL . 98.4 m-20 -61.03 -14.44 23.34 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.68 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -39.1 53.67 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.861 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.87 -26.46 22.76 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.793 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.649 HD23 HD12 ' A' ' 44' ' ' LEU . 15.8 mt -58.16 -32.88 68.62 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.334 -0.946 . . . . 0.0 111.059 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -64.2 76.68 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 118.841 -1.143 . . . . 0.0 110.053 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 167.07 -13.89 0.07 OUTLIER Glycine 0 C--N 1.294 -1.775 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.649 HD12 HD23 ' A' ' 41' ' ' LEU . 20.3 mt -87.86 170.92 10.76 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.505 ' H ' ' HB3' ' A' ' 48' ' ' GLU . 15.7 m -94.81 165.67 12.36 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.754 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -50.2 -56.83 9.44 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.22 -23.4 66.42 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 119.4 -0.92 . . . . 0.0 111.24 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.505 ' HB3' ' H ' ' A' ' 45' ' ' SER . 42.0 tt0 -84.96 -15.57 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.157 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.5 mt -89.94 -42.23 14.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.586 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mt -59.83 -49.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.012 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -54.4 -39.14 66.98 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.421 HD22 ' CD1' ' A' ' 44' ' ' LEU . 5.1 mp -73.52 -33.92 65.0 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.213 -0.995 . . . . 0.0 111.042 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.1 mttt -66.84 -5.4 12.18 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.43 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 55' ' ' ARG . 9.0 tp60 -96.89 -77.07 0.5 Allowed 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.767 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' N ' ' A' ' 58' ' ' THR . 1.2 mmp_? -42.4 -58.09 2.35 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.166 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -47.48 -38.3 13.47 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 118.782 -1.167 . . . . 0.0 109.888 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -76.7 -25.06 53.19 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.89 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' ARG . 37.0 m -77.38 -38.09 50.69 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.873 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.468 ' O ' ' N ' ' A' ' 61' ' ' ASN . 29.2 mt -59.17 -60.8 3.28 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.607 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.421 ' HG3' HG13 ' A' ' 30' ' ' VAL . 15.7 mtpp -43.38 -22.16 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.609 -0.837 . . . . 0.0 111.188 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 59' ' ' LEU . 25.0 t30 -93.56 -42.89 8.97 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.157 -1.017 . . . . 0.0 111.437 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -62.83 -160.9 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.308 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.22 96.36 Favored Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.623 -1.275 . . . . 0.0 110.903 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--N 1.305 -1.337 0 C-N-CA 119.133 -1.027 . . . . 0.0 110.859 -179.966 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.498 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.445 ' OG1' ' OE1' ' A' ' 28' ' ' GLU . 2.8 p -57.73 -175.03 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 118.796 -1.162 . . . . 0.0 110.771 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -69.9 -38.52 76.34 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.86 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 27' ' ' GLU . 6.0 pt-20 -61.35 -41.48 97.13 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.904 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.445 ' OE1' ' OG1' ' A' ' 25' ' ' THR . 0.3 OUTLIER -52.24 -49.85 63.19 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.578 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.474 HD21 HD11 ' A' ' 24' ' ' LEU . 57.7 mt -43.12 -41.5 3.68 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.65 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.45 ' CG2' HD13 ' A' ' 59' ' ' LEU . 2.2 t -78.66 -59.11 3.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.573 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.9 -28.56 9.89 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 118.877 -1.129 . . . . 0.0 109.435 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 34.3 mtp -91.0 96.32 10.56 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.549 -0.86 . . . . 0.0 111.078 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' N ' ' A' ' 37' ' ' LEU . 60.4 p -54.15 178.47 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.915 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 67.4 t -50.04 -61.05 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.346 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.9 ttp180 -51.01 -43.48 60.85 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.583 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -72.63 -30.97 64.78 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.208 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 33' ' ' SER . 56.2 tp -73.86 -43.65 57.94 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.411 ' O ' HD11 ' A' ' 41' ' ' LEU . 68.3 m-20 -65.69 -7.41 15.28 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.119 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.68 -12.83 38.38 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.762 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -98.1 -35.52 10.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.475 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.643 ' CB ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -77.94 14.21 1.18 Allowed 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 118.68 -1.208 . . . . 0.0 112.149 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.573 ' N ' HD12 ' A' ' 41' ' ' LEU . 36.2 mtp85 -51.21 90.1 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.825 -1.15 . . . . 0.0 110.776 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 128.92 4.51 5.12 Favored Glycine 0 N--CA 1.484 1.861 0 C-N-CA 119.925 -1.131 . . . . 0.0 110.72 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.643 HD12 ' CB ' ' A' ' 41' ' ' LEU . 20.9 mt -85.15 147.18 26.74 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.126 -1.43 . . . . 0.0 110.975 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.481 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 14.8 t -80.31 175.41 10.68 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.345 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.656 ' H ' ' CD ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -60.26 -38.19 82.76 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.22 -0.992 . . . . 0.0 110.746 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -82.12 -18.0 44.47 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.502 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.481 ' HB2' ' H ' ' A' ' 45' ' ' SER . 2.4 mt-10 -87.62 -23.75 24.17 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.247 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.522 HG12 HD22 ' A' ' 41' ' ' LEU . 42.0 mt -80.65 -32.28 12.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.099 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.52 -58.72 5.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.401 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -52.83 -33.64 50.33 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.514 -0.874 . . . . 0.0 110.802 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.22 -33.37 43.77 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.236 -0.985 . . . . 0.0 110.549 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -80.93 -14.64 57.8 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.369 -0.933 . . . . 0.0 110.621 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.31 -63.2 1.16 Allowed 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.449 ' O ' ' N ' ' A' ' 58' ' ' THR . 70.9 mtt180 -45.92 -50.96 14.03 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.316 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -44.48 -38.32 4.03 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.285 -0.966 . . . . 0.0 110.444 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -75.12 -31.62 61.17 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.103 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.449 ' N ' ' O ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -68.02 -38.54 82.68 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.217 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.45 HD13 ' CG2' ' A' ' 30' ' ' VAL . 25.4 mt -65.21 -43.94 89.9 Favored 'General case' 0 C--N 1.306 -1.314 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.78 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -59.62 -22.36 61.73 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -95.86 -48.02 5.9 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.526 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -57.07 -175.86 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.028 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -45.59 -46.33 12.59 Favored Glycine 0 N--CA 1.49 2.289 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.304 -1.376 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.367 -179.95 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.764 ' CD1' ' H ' ' A' ' 25' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.212 -0.886 0 CA-C-O 121.371 0.605 . . . . 0.0 110.701 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.764 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -175.81 162.0 2.6 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.634 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.562 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -71.54 -46.94 58.13 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.105 -1.038 . . . . 0.0 109.998 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -20.19 39.26 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.266 -0.974 . . . . 0.0 109.852 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' VAL . 2.4 mt-10 -77.7 -47.21 19.71 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.795 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 28' ' ' GLU . 24.1 mt -39.68 -29.77 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.64 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.485 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -89.37 -63.05 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.626 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.636 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.41 -28.86 1.48 Allowed 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.042 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 6.1 mtp -88.07 91.07 8.64 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.226 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -41.34 154.59 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.968 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -39.87 -38.29 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.054 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.457 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 34.5 ttp180 -62.45 -46.68 87.44 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.032 -1.067 . . . . 0.0 109.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.457 ' CD ' ' HE ' ' A' ' 35' ' ' ARG . 2.9 mp0 -67.67 -37.95 83.07 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.326 -0.949 . . . . 0.0 109.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.86 -46.75 77.32 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.654 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -57.24 -19.83 23.76 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.17 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.41 -35.34 35.33 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.531 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.61 -37.22 42.83 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.861 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.65 ' C ' ' H ' ' A' ' 43' ' ' GLY . 49.2 mt -54.73 -13.7 1.12 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.026 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -69.9 27.7 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.361 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.65 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -144.57 -3.16 0.73 Allowed Glycine 0 C--N 1.292 -1.896 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.1 mt -107.74 149.9 27.61 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.041 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.35 152.52 30.39 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.288 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.543 ' HA ' HD12 ' A' ' 49' ' ' ILE . 6.7 pttt -46.43 -28.16 1.29 Allowed 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.833 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -82.46 -38.86 23.36 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.635 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -77.16 -15.1 59.66 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.056 -1.058 . . . . 0.0 109.628 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 46' ' ' LYS . 57.6 mt -80.45 -39.07 18.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 C-N-CA 119.544 -0.862 . . . . 0.0 109.697 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.489 HG22 ' N ' ' A' ' 51' ' ' GLN . 9.5 mt -62.9 -62.27 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.275 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.489 ' N ' HG22 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -45.77 -28.97 1.16 Allowed 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.875 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.44 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -78.56 -41.78 31.08 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.246 -0.982 . . . . 0.0 110.898 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.5 mttp -50.25 -20.34 1.02 Allowed 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.422 ' O ' ' N ' ' A' ' 57' ' ' ARG . 37.9 tt0 -74.22 -73.13 0.24 Allowed 'General case' 0 C--N 1.301 -1.514 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.785 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 58' ' ' THR . 4.8 mmp_? -43.15 -51.64 5.87 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.591 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -45.71 -36.48 5.01 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.808 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 54' ' ' GLN . 13.0 ttt85 -71.17 -27.96 63.9 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.647 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.483 ' N ' ' O ' ' A' ' 55' ' ' ARG . 23.8 m -72.21 -42.63 65.56 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.485 HD13 ' CG2' ' A' ' 30' ' ' VAL . 36.7 mt -60.91 -57.97 10.39 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 118.733 -1.187 . . . . 0.0 110.498 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.41 -13.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.426 -0.909 . . . . 0.0 111.23 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.413 ' N ' ' C ' ' A' ' 59' ' ' LEU . 65.6 t30 -91.94 -62.2 1.47 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 119.338 -0.945 . . . . 0.0 112.133 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 64' ' ' TYR . 7.6 ptm180 -51.61 173.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.26 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -39.06 -30.45 0.12 Allowed Glycine 0 N--CA 1.498 2.775 0 C-N-CA 119.889 -1.148 . . . . 0.0 110.462 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.436 ' N ' ' O ' ' A' ' 62' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.302 -1.486 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.158 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.475 ' CD1' ' ND1' ' A' ' 40' ' ' HIS . 6.0 mt . . . . . 0 CA--C 1.501 -0.913 0 CA-C-O 121.146 0.498 . . . . 0.0 110.683 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.503 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -58.06 -174.03 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.143 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.621 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -59.84 -56.89 16.12 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.752 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 31' ' ' THR . 6.6 mp0 -64.33 -22.57 67.0 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.51 ' O ' ' CG ' ' A' ' 32' ' ' MET . 10.3 mm-40 -83.54 -9.74 58.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.207 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 56' ' ' ARG . 13.8 mt -87.33 -24.75 24.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.434 -0.907 . . . . 0.0 111.141 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.699 HG21 ' HB3' ' A' ' 59' ' ' LEU . 6.5 t -101.95 -39.78 6.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.066 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.672 HG23 ' O ' ' A' ' 27' ' ' GLU . 0.8 OUTLIER -45.53 -46.61 14.09 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.51 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -94.44 133.72 37.73 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.052 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 83.5 p -64.72 -150.63 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.963 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -84.12 -42.35 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 119.339 -0.945 . . . . 0.0 111.302 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -56.57 -43.53 80.1 Favored 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.207 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 36' ' ' GLU . 8.9 mp0 -70.0 -26.47 64.08 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.344 -0.943 . . . . 0.0 109.918 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 24' ' ' LEU . 36.6 tp -76.12 -54.48 6.77 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.352 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -58.89 -11.26 3.1 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.395 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 1.7 tt0 -76.24 -38.86 55.77 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.85 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.475 ' ND1' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -90.55 -37.42 13.86 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.562 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.822 HD23 HD12 ' A' ' 44' ' ' LEU . 18.0 mt -45.94 -34.68 4.09 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.519 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.6 mtp180 -49.94 91.31 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.071 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 143.92 -15.53 2.17 Favored Glycine 0 C--N 1.295 -1.74 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.822 HD12 HD23 ' A' ' 41' ' ' LEU . 18.9 mt -90.44 140.29 29.86 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 119.114 -1.035 . . . . 0.0 110.682 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -56.18 -178.24 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.565 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.526 ' O ' HD13 ' A' ' 50' ' ' ILE . 21.6 mmtt -77.25 -21.0 54.4 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -89.15 -29.47 19.31 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.921 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.39 -14.51 59.36 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.132 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.49 HG12 HD22 ' A' ' 41' ' ' LEU . 8.4 mt -83.9 -43.06 17.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.446 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.526 HD13 ' O ' ' A' ' 46' ' ' LYS . 1.5 mp -62.76 -56.97 14.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.666 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.893 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.494 ' N ' HG22 ' A' ' 50' ' ' ILE . 18.8 pt20 -51.36 -29.86 16.79 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.851 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.443 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 1.2 mp -81.11 -25.79 36.7 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.933 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -81.62 -9.17 59.73 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.016 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -81.33 -75.14 0.3 Allowed 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.032 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -44.59 -42.38 7.31 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.279 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.432 ' HB2' HD22 ' A' ' 29' ' ' LEU . 7.7 ttt-85 -50.52 -41.44 53.72 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.16 -1.016 . . . . 0.0 109.748 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.485 ' HG2' HH11 ' A' ' 57' ' ' ARG . 57.7 mmt-85 -74.96 -31.59 61.5 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.278 -0.969 . . . . 0.0 110.063 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.0 m -67.16 -38.14 84.96 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.337 -0.945 . . . . 0.0 110.409 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.699 ' HB3' HG21 ' A' ' 30' ' ' VAL . 19.3 mt -67.71 -34.33 76.65 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.639 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HZ2' ' HB3' ' A' ' 60' ' ' LYS . 10.6 mtpp -67.46 -15.17 63.52 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.54 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -97.04 -49.1 5.14 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.748 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.48 ' O ' ' N ' ' A' ' 64' ' ' TYR . 57.9 ttt-85 -51.38 169.44 0.05 Allowed 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.424 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.48 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.62 -23.45 0.11 Allowed Glycine 0 N--CA 1.493 2.456 0 C-N-CA 119.608 -1.282 . . . . 0.0 110.949 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.48 ' N ' ' O ' ' A' ' 62' ' ' ARG . 6.1 t80 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.104 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 24' ' ' LEU . 1.2 tp . . . . . 0 C--O 1.216 -0.7 0 CA-C-O 122.179 0.99 . . . . 0.0 110.073 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.471 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -59.54 163.86 3.88 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.777 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.09 -41.66 26.79 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.64 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.861 ' O ' HG23 ' A' ' 31' ' ' THR . 30.2 mt-10 -70.74 -32.42 69.58 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.713 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 28' ' ' GLU . 1.6 mp0 -66.21 -35.35 80.2 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.414 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 mt -60.25 -29.25 68.66 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.693 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.82 HG21 ' HB3' ' A' ' 59' ' ' LEU . 17.1 t -92.66 -42.78 13.5 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.167 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.844 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.861 HG23 ' O ' ' A' ' 27' ' ' GLU . 22.4 p -46.05 -37.29 6.54 Favored 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.591 -1.244 . . . . 0.0 107.803 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.6 ptm -92.92 123.84 36.47 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.856 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -66.05 -177.47 0.5 Allowed 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.019 -1.072 . . . . 0.0 110.793 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.522 ' O ' ' N ' ' A' ' 37' ' ' LEU . 44.7 t -62.23 -55.17 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.672 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -47.31 -30.02 2.88 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 118.696 -1.202 . . . . 0.0 109.432 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -85.37 -26.49 26.45 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.301 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.591 HD13 ' HE ' ' A' ' 56' ' ' ARG . 5.0 tp -74.63 -41.21 60.79 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.149 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -51.08 -37.21 44.34 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.953 -1.099 . . . . 0.0 109.484 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.21 -37.29 77.09 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.105 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.8 -45.57 16.73 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.735 HD22 HG12 ' A' ' 49' ' ' ILE . 30.5 mt -50.22 -29.11 8.75 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.486 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -52.1 88.77 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.339 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 139.7 -13.27 3.17 Favored Glycine 0 N--CA 1.481 1.678 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.2 mt -97.74 137.47 36.57 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.83 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.513 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 0.4 OUTLIER -89.34 173.25 8.48 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.584 -0.846 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.5 mmtt -45.99 -46.91 16.68 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.26 -31.78 70.55 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.981 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.513 ' HB2' ' H ' ' A' ' 45' ' ' SER . 23.9 mt-10 -83.42 -21.5 32.96 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.735 HG12 HD22 ' A' ' 41' ' ' LEU . 2.3 mt -82.42 -34.74 12.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.004 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 22.8 mt -59.49 -57.09 13.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.583 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.431 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 4.2 mm100 -42.07 -31.21 0.34 Allowed 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.168 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.5 ' C ' ' H ' ' A' ' 54' ' ' GLN . 34.2 mt -88.26 -32.86 18.3 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -64.74 4.87 0.36 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.356 -0.938 . . . . 0.0 111.008 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 52' ' ' LEU . 31.7 tt0 -99.21 -89.16 0.32 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.486 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 54' ' ' GLN . 12.4 tpt180 -43.65 -50.55 7.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.688 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.591 ' HE ' HD13 ' A' ' 37' ' ' LEU . 64.7 ttt-85 -48.98 -31.18 7.01 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.766 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 54' ' ' GLN . 0.2 OUTLIER -76.67 -32.15 57.75 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.644 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 m -69.59 -41.71 75.4 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.962 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.82 ' HB3' HG21 ' A' ' 30' ' ' VAL . 40.8 mt -70.72 -35.29 72.63 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.134 -1.026 . . . . 0.0 110.616 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -72.6 -13.22 61.33 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.583 -0.847 . . . . 0.0 111.517 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -91.55 -67.01 0.88 Allowed 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.16 -1.016 . . . . 0.0 112.155 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HG3' ' H ' ' A' ' 64' ' ' TYR . 4.0 ptm180 -51.11 173.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.49 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -36.32 -35.73 0.12 Allowed Glycine 0 N--CA 1.5 2.947 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.289 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.543 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--N 1.301 -1.514 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.424 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.824 HD11 ' SD ' ' A' ' 32' ' ' MET . 9.1 tp . . . . . 0 C--O 1.216 -0.691 0 CA-C-O 121.857 0.837 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.7 p -51.3 169.31 0.05 Allowed 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.34 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.89 -8.58 55.24 Favored 'General case' 0 C--N 1.299 -1.603 0 C-N-CA 118.897 -1.121 . . . . 0.0 110.5 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' O ' ' OG1' ' A' ' 31' ' ' THR . 18.3 mt-10 -90.17 -14.54 33.32 Favored 'General case' 0 C--N 1.295 -1.798 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.237 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' LEU . 33.6 mm-40 -90.92 -48.87 6.75 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 119.857 -0.737 . . . . 0.0 112.014 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' A' ' 28' ' ' GLU . 14.5 mt -39.66 -46.42 1.83 Allowed 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 119.819 -0.753 . . . . 0.0 111.536 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.639 HG13 ' CG ' ' A' ' 60' ' ' LYS . 12.0 t -70.78 -57.64 7.28 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.233 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -51.7 -20.22 1.98 Allowed 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 118.597 -1.241 . . . . 0.0 109.444 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.824 ' SD ' HD11 ' A' ' 24' ' ' LEU . 75.2 mtp -89.98 90.61 8.23 Favored 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.646 -0.821 . . . . 0.0 110.666 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 p -49.0 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.746 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 61.1 t -139.88 -26.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 C-N-CA 119.876 -0.73 . . . . 0.0 110.307 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.484 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -76.81 -41.29 44.96 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.781 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 4.4 tp10 -76.34 -29.96 57.44 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.431 -0.908 . . . . 0.0 109.514 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.1 tp -71.44 -43.52 66.54 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.878 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -58.47 -33.97 70.36 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.316 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -33.55 68.87 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' HD11 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -93.01 -35.48 13.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.516 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.604 HD23 HD12 ' A' ' 44' ' ' LEU . 40.4 mt -62.7 -15.58 53.4 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.135 -1.026 . . . . 0.0 110.991 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -70.34 39.76 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.958 -1.097 . . . . 0.0 110.261 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.586 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -158.72 -2.49 0.07 OUTLIER Glycine 0 C--N 1.293 -1.807 0 N-CA-C 108.793 -1.723 . . . . 0.0 108.793 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 41' ' ' LEU . 22.3 mt -107.02 157.38 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 119.831 -0.748 . . . . 0.0 110.911 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.27 -176.04 4.97 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.803 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -66.66 -39.7 88.29 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.811 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.25 -36.5 69.07 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.801 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -74.08 -19.26 60.66 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.454 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mt -80.89 -38.93 17.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.722 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.8 mt -65.31 -50.56 72.6 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.328 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.946 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -54.12 -40.84 67.71 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.288 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.449 HD22 ' CD1' ' A' ' 44' ' ' LEU . 1.7 mp -74.15 -37.49 64.02 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.293 -0.963 . . . . 0.0 110.246 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.56 -29.64 69.28 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.991 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -86.36 -45.16 11.46 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.384 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 -51.54 -61.57 2.16 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 119.256 -0.978 . . . . 0.0 109.936 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.503 ' C ' ' CD ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -47.28 -31.03 3.47 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 118.924 -1.11 . . . . 0.0 109.217 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.64 -37.96 48.88 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -60.47 -42.17 95.68 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.338 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.546 HD13 HG23 ' A' ' 30' ' ' VAL . 13.2 mt -54.83 -47.46 74.08 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.592 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.639 ' CG ' HG13 ' A' ' 30' ' ' VAL . 39.2 mtpt -71.28 4.95 2.47 Favored 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.286 -0.966 . . . . 0.0 110.689 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -139.65 19.16 2.52 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.477 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 63' ' ' GLY . 35.3 ttt180 -137.1 -111.24 0.18 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.121 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.46 ' N ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.87 -75.47 0.76 Allowed Glycine 0 N--CA 1.491 2.309 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.926 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--N 1.304 -1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 111.225 -179.915 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.51 ' CD1' ' C ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.237 0.542 . . . . 0.0 109.905 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.11 149.51 27.97 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.203 -0.999 . . . . 0.0 110.559 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -48.11 -40.73 24.43 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.826 -1.149 . . . . 0.0 109.941 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.21 -24.69 63.35 Favored 'General case' 0 C--N 1.299 -1.624 0 C-N-CA 119.444 -0.903 . . . . 0.0 111.214 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.49 -40.46 29.66 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.259 -0.976 . . . . 0.0 111.061 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 29' ' ' LEU . 13.9 mt -43.15 -34.27 1.06 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.593 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.551 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.6 t -85.88 -63.41 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.728 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.301 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.26 -28.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.145 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 9.0 mtp -88.23 91.59 8.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.223 -0.991 . . . . 0.0 110.507 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.506 ' O ' ' N ' ' A' ' 37' ' ' LEU . 2.6 p -55.39 -178.76 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.899 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 45.6 t -49.58 -52.68 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 111.2 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -54.72 -54.21 44.87 Favored 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.457 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -67.08 -30.3 70.29 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.415 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 33' ' ' SER . 9.7 tp -74.3 -39.89 62.62 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.173 -1.011 . . . . 0.0 110.109 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -58.98 -20.47 53.08 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.569 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 60.3 tp60 -72.0 -31.14 65.94 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.53 -43.49 10.19 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.155 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.884 HD22 HD13 ' A' ' 49' ' ' ILE . 19.0 mt -45.94 -47.52 16.46 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 119.539 -0.864 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 41' ' ' LEU . 4.5 mtp85 -41.78 94.52 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.571 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 141.16 -19.45 2.68 Favored Glycine 0 C--N 1.296 -1.646 0 N-CA-C 109.065 -1.614 . . . . 0.0 109.065 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.795 HD12 HD23 ' A' ' 41' ' ' LEU . 19.3 mt -84.82 147.51 26.78 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.621 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 48' ' ' GLU . 52.8 p -76.61 151.91 36.08 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.742 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.554 ' H ' ' HD2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -45.6 -35.71 4.21 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.268 -0.973 . . . . 0.0 110.603 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -77.7 -31.14 52.17 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.283 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 45' ' ' SER . 5.8 tt0 -77.94 -20.52 52.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.041 -1.064 . . . . 0.0 109.12 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.884 HD13 HD22 ' A' ' 41' ' ' LEU . 1.6 mm -72.83 -46.46 52.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.585 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 mt -58.81 -56.02 19.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -54.8 -37.97 66.73 Favored 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.41 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.26 -39.77 65.15 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.094 -1.042 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.7 mmmp? -62.39 -11.57 16.43 Favored 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.841 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -84.48 -56.53 3.57 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.406 ' H ' ' HG2' ' A' ' 55' ' ' ARG . 15.1 mmt180 -55.52 -51.39 67.2 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.027 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -49.54 -38.12 29.55 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.995 -1.082 . . . . 0.0 109.697 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -33.55 67.18 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.983 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.464 ' O ' ' N ' ' A' ' 62' ' ' ARG . 96.0 m -64.09 -41.51 97.27 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.217 -0.993 . . . . 0.0 110.485 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.551 HD13 ' CG2' ' A' ' 30' ' ' VAL . 31.7 mt -54.49 -60.35 3.47 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.754 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp -47.57 -20.47 0.26 Allowed 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.444 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -106.25 -29.66 9.67 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.594 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' THR . 15.3 ttt180 -76.39 -147.54 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.032 -1.067 . . . . 0.0 111.483 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.456 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -57.73 -61.01 7.95 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.829 -1.176 . . . . 0.0 111.611 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--N 1.305 -1.344 0 C-N-CA 119.172 -1.011 . . . . 0.0 111.546 -179.868 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.54 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.95 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.512 ' H ' ' HG3' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -80.38 -157.36 0.15 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.131 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -76.85 -53.73 7.52 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.972 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.766 ' O ' HG23 ' A' ' 31' ' ' THR . 63.1 mt-10 -62.4 -24.28 67.31 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.206 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 25' ' ' THR . 37.1 mm-40 -63.87 -29.67 70.83 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.486 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.71 -45.72 74.29 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.696 0.76 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.809 HG21 ' HB3' ' A' ' 59' ' ' LEU . 41.4 t -78.42 -44.19 26.58 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.006 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.766 HG23 ' O ' ' A' ' 27' ' ' GLU . 6.6 p -51.09 -35.39 34.85 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 10.3 mtm -92.52 123.58 35.92 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.549 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -162.86 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.247 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.99 -48.95 36.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.944 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -61.83 -31.25 71.47 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.604 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -77.42 -36.9 52.79 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.222 -0.991 . . . . 0.0 109.928 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 tp -74.49 -42.89 58.19 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.105 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -63.23 -14.36 48.36 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.944 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.09 -32.03 64.72 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.486 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.477 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -99.09 -27.13 13.98 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.226 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.697 HD23 HD12 ' A' ' 44' ' ' LEU . 17.5 mt -54.05 -33.53 57.67 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 119.218 -0.993 . . . . 0.0 111.765 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.489 ' CB ' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -63.61 78.26 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.386 -179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 165.76 -14.61 0.08 OUTLIER Glycine 0 C--N 1.296 -1.679 0 N-CA-C 109.134 -1.586 . . . . 0.0 109.134 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.697 HD12 HD23 ' A' ' 41' ' ' LEU . 22.4 mt -88.93 152.67 21.58 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 46' ' ' LYS . 11.1 t -74.19 155.19 38.62 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.206 -0.998 . . . . 0.0 110.315 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 45' ' ' SER . 1.0 OUTLIER -41.78 -43.24 2.87 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.504 -0.878 . . . . 0.0 111.202 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.69 -48.35 72.36 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.335 -0.946 . . . . 0.0 111.103 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.3 OUTLIER -62.52 -22.62 66.43 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.698 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mm -76.01 -43.15 38.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.749 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -69.55 -40.41 79.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 C-N-CA 118.986 -1.085 . . . . 0.0 109.339 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -57.56 -49.25 76.98 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.878 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.57 ' C ' ' H ' ' A' ' 54' ' ' GLN . 6.0 mp -69.97 -42.31 73.32 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.245 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.436 ' HD2' HH21 ' A' ' 56' ' ' ARG . 0.5 OUTLIER -61.17 5.54 0.06 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.018 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 52' ' ' LEU . 30.2 tt0 -100.32 -76.34 0.56 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.291 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -42.71 -47.84 5.46 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.351 -0.94 . . . . 0.0 110.506 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.436 HH21 ' HD2' ' A' ' 53' ' ' LYS . 4.2 tmm_? -45.72 -36.22 4.84 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.206 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.651 ' CA ' ' HE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -74.82 -34.29 62.32 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.46 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.46 ' N ' ' HG3' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -77.74 -36.97 50.24 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.536 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.809 ' HB3' HG21 ' A' ' 30' ' ' VAL . 20.4 mt -62.53 -21.12 65.3 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.315 -0.954 . . . . 0.0 111.409 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.51 ' HZ2' ' HA ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -90.41 0.97 57.06 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -121.49 -33.32 3.66 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.665 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -65.94 -149.1 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.582 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.21 -27.57 73.6 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.379 -1.391 . . . . 0.0 110.369 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.9 t80 . . . . . 0 C--N 1.308 -1.237 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.949 -179.946 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.571 HD11 HD21 ' A' ' 29' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 121.312 0.577 . . . . 0.0 110.513 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.14 -174.48 3.67 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.437 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -52.43 51.05 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.355 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -56.07 -38.23 70.38 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.861 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -46.88 71.24 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.922 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.571 HD21 HD11 ' A' ' 24' ' ' LEU . 69.7 mt -47.7 -39.67 18.13 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.573 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.428 ' C ' ' N ' ' A' ' 32' ' ' MET . 2.0 t -79.25 -58.95 3.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.915 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.76 -26.66 0.69 Allowed 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.09 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.428 ' N ' ' C ' ' A' ' 30' ' ' VAL . 62.7 mtp -91.05 97.85 11.41 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.923 -1.035 . . . . 0.0 109.993 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.3 m -48.94 -94.27 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 119.821 -0.752 . . . . 0.0 111.58 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.8 t -140.58 -31.59 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.593 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.5 ptt-85 -76.86 -23.76 52.65 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.897 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.34 -31.37 18.95 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.891 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tp -74.35 -39.59 62.69 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.272 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -61.67 -14.84 34.82 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.907 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -89.99 0.04 57.32 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.496 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.42 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -113.38 -29.21 7.3 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.373 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.601 HD12 ' N ' ' A' ' 42' ' ' ARG . 0.2 OUTLIER -84.01 3.36 34.73 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.469 -1.293 . . . . 0.0 112.789 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.601 ' N ' HD12 ' A' ' 41' ' ' LEU . 5.8 mtm180 -50.86 90.68 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.999 -1.08 . . . . 0.0 110.743 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 132.65 0.37 4.44 Favored Glycine 0 N--CA 1.482 1.76 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.8 mt -89.77 124.94 35.08 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 118.719 -1.193 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.6 m -60.36 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.326 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.483 ' O ' HD13 ' A' ' 50' ' ' ILE . 3.3 tmtm? -73.88 -38.21 64.48 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.765 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.733 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 9.9 pm0 -83.15 -11.62 57.75 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.044 -1.062 . . . . 0.0 110.565 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.61 -21.68 21.6 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 119.388 -0.925 . . . . 0.0 110.176 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.513 HG22 HD12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.86 -27.7 15.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 C-N-CA 119.424 -0.911 . . . . 0.0 109.627 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.513 HD12 HG22 ' A' ' 49' ' ' ILE . 1.4 mp -70.29 -33.4 54.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.534 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.422 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 10.8 mm100 -58.03 -43.09 86.58 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.563 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 52' ' ' LEU . 4.4 mm? -69.49 -35.79 75.89 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.681 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HD3' HH21 ' A' ' 56' ' ' ARG . 15.0 mmtp -64.47 -0.52 1.36 Allowed 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.416 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.0 tp60 -86.46 -79.56 0.26 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.963 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -54.08 -38.0 64.83 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.039 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.438 HH21 ' HD3' ' A' ' 53' ' ' LYS . 45.9 ttp85 -59.08 -31.27 68.74 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.013 -1.075 . . . . 0.0 109.724 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -79.43 -28.45 41.71 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.3 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.9 m -71.05 -34.72 71.5 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.294 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.415 ' HB3' HG21 ' A' ' 30' ' ' VAL . 65.3 mt -69.87 -48.61 58.1 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.163 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -63.15 -10.6 15.63 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.644 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -89.4 -62.84 1.39 Allowed 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.395 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -53.36 178.21 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.608 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.409 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -40.09 -32.49 0.39 Allowed Glycine 0 N--CA 1.495 2.599 0 C-N-CA 119.844 -1.17 . . . . 0.0 110.62 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.6 t80 . . . . . 0 C--N 1.306 -1.292 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.429 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.474 ' HA ' HD22 ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 121.108 0.48 . . . . 0.0 110.438 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -169.47 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.761 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.678 ' HB3' HD11 ' A' ' 59' ' ' LEU . 29.2 m-20 -73.3 -58.04 3.59 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.101 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -52.67 -8.56 0.09 Allowed 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.998 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.532 ' H ' ' C ' ' A' ' 26' ' ' ASP . 2.2 mt-10 -90.57 -32.63 16.21 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.641 -0.824 . . . . 0.0 111.424 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.463 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 92.4 mt -65.45 -23.97 67.06 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.73 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.693 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.9 t -96.63 -59.92 2.93 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.006 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.264 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.463 ' CG2' ' N ' ' A' ' 32' ' ' MET . 14.6 t -41.43 -32.63 0.34 Allowed 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 118.989 -1.084 . . . . 0.0 108.688 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.515 ' SD ' ' O ' ' A' ' 28' ' ' GLU . 14.6 ptm -91.06 119.24 31.05 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.415 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 41.3 t -57.86 -174.85 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.471 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.503 ' N ' ' OG ' ' A' ' 33' ' ' SER . 48.7 t -68.97 -46.18 79.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.255 -0.978 . . . . 0.0 110.672 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -50.69 -46.39 58.78 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.174 -1.01 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.96 -25.36 63.6 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.179 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.464 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -78.94 -49.33 12.98 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.236 -0.986 . . . . 0.0 109.348 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.45 ' ND2' HG12 ' A' ' 34' ' ' VAL . 69.3 m-20 -59.6 -16.98 29.46 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.913 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -78.0 -33.46 51.25 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.361 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.461 ' O ' ' N ' ' A' ' 42' ' ' ARG . 0.7 OUTLIER -89.47 -45.16 9.63 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.364 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.617 HD13 HG23 ' A' ' 49' ' ' ILE . 42.4 mt -46.26 -18.9 0.06 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.703 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' N ' ' O ' ' A' ' 40' ' ' HIS . 1.4 ttp180 -56.35 -10.03 0.82 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.418 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.43 ' N ' ' C ' ' A' ' 41' ' ' LEU . . . -103.76 -1.78 46.17 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.8 mt -110.31 153.51 24.78 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 119.595 -0.842 . . . . 0.0 111.05 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.413 ' O ' ' N ' ' A' ' 48' ' ' GLU . 66.4 m -84.3 154.63 22.83 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.796 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -44.61 -36.33 3.01 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.792 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -80.27 -30.2 38.36 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.589 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 tp10 -81.9 -17.01 48.7 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.529 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.617 HG23 HD13 ' A' ' 41' ' ' LEU . 70.0 mt -82.06 -33.8 11.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.819 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.3 mt -61.21 -59.32 4.46 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.814 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -51.36 -31.14 21.14 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.139 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.429 ' HA ' HD12 ' A' ' 52' ' ' LEU . 9.1 tp -83.66 -16.15 46.16 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.422 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -81.13 -27.35 35.56 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.122 -1.031 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -68.04 -64.25 0.9 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.192 -1.003 . . . . 0.0 110.392 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.55 -54.01 5.2 Favored 'General case' 0 C--N 1.307 -1.274 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.36 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.419 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 10.9 ttt180 -42.5 -35.93 1.2 Allowed 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.95 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.2 tpt85 -72.55 -31.75 65.52 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.416 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 55' ' ' ARG . 17.6 m -67.5 -33.21 74.64 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.094 -1.042 . . . . 0.0 110.295 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.693 ' HB3' HG21 ' A' ' 30' ' ' VAL . 26.7 mt -68.18 -36.26 79.32 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.222 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -57.16 -16.84 8.79 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.42 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -87.91 -53.6 4.66 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.936 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.06 171.15 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.933 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -44.03 -39.28 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 119.365 -1.398 . . . . 0.0 110.004 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.302 -1.457 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.187 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.526 HD23 ' CD2' ' A' ' 29' ' ' LEU . 6.2 tp . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 121.728 0.775 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.97 161.35 0.07 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.193 -1.003 . . . . 0.0 110.958 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.55 ' CB ' HD11 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.15 -41.5 94.65 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.918 179.879 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -59.66 -18.66 43.75 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.818 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.18 -55.1 3.66 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.266 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.526 ' CD2' HD23 ' A' ' 24' ' ' LEU . 55.0 mt -37.78 -47.91 1.05 Allowed 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.983 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.468 ' CG2' HD13 ' A' ' 59' ' ' LEU . 2.3 t -67.27 -57.25 10.49 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.974 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.184 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.62 -27.84 12.51 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 118.577 -1.249 . . . . 0.0 108.854 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.414 ' CE ' HD21 ' A' ' 24' ' ' LEU . 3.2 mtp -91.34 100.3 13.11 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.34 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.1 t -59.02 159.61 6.99 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.135 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' LEU . 41.2 t -45.87 -54.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.99 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -47.63 -41.87 23.02 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 118.643 -1.223 . . . . 0.0 109.997 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -76.82 -23.65 52.78 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.722 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 34' ' ' VAL . 14.6 tp -73.37 -46.06 51.24 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.885 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -49.9 -32.43 14.57 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.059 -1.057 . . . . 0.0 110.788 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.497 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -62.18 -18.54 61.28 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.801 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CD2' HD22 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -108.57 -21.33 12.76 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.873 -0.731 . . . . 0.0 111.152 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.654 HD23 HD12 ' A' ' 44' ' ' LEU . 31.1 mt -70.13 -23.94 63.1 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.299 -0.96 . . . . 0.0 111.695 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -62.2 6.95 0.07 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 118.613 -1.235 . . . . 0.0 110.685 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.605 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -120.53 2.62 12.36 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.654 HD12 HD23 ' A' ' 41' ' ' LEU . 24.1 mt -110.98 155.89 22.04 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 m -77.58 -172.68 2.66 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.333 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.47 ' HG3' ' N ' ' A' ' 47' ' ' GLU . 24.4 pttt -68.19 -49.6 59.79 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.849 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.47 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 13.3 tp10 -69.7 -26.46 64.36 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.745 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -76.91 -19.99 56.75 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.489 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.447 HG12 HD22 ' A' ' 41' ' ' LEU . 9.4 mt -82.25 -43.22 19.22 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 119.214 -0.995 . . . . 0.0 109.936 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 63.3 mt -62.01 -53.48 47.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 C-N-CA 119.423 -0.911 . . . . 0.0 110.28 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -49.74 -45.48 49.43 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.076 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 tp -62.49 -35.58 79.82 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.517 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -65.43 -11.3 41.41 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.248 -0.981 . . . . 0.0 111.253 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -91.0 -45.64 8.6 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.199 -1.0 . . . . 0.0 111.324 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -64.05 -56.53 14.3 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 118.836 -1.146 . . . . 0.0 110.237 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 35.6 ttt-85 -50.37 -30.74 12.94 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.988 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -77.03 -29.93 55.49 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.417 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 m -69.83 -36.24 75.44 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.867 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.55 HD11 ' CB ' ' A' ' 26' ' ' ASP . 41.7 mt -66.53 -49.07 67.71 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.079 -1.048 . . . . 0.0 110.544 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mmmt -53.58 -18.61 3.02 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.612 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -96.13 -47.49 6.04 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.278 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.444 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -56.63 179.59 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.052 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.444 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -42.59 -43.12 4.92 Favored Glycine 0 N--CA 1.493 2.467 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.661 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--N 1.303 -1.421 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.91 -179.917 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.456 HD11 ' SD ' ' A' ' 32' ' ' MET . 5.1 tp . . . . . 0 C--O 1.216 -0.684 0 CA-C-O 122.071 0.939 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.407 ' C ' ' O ' ' A' ' 24' ' ' LEU . 1.2 p -41.97 152.81 0.07 Allowed 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.727 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.609 ' CG ' HH21 ' A' ' 55' ' ' ARG . 10.1 m-20 -52.28 -38.99 59.88 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 118.783 -1.167 . . . . 0.0 110.279 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -62.69 -18.24 62.08 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 119.467 -0.893 . . . . 0.0 111.738 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -90.76 -48.71 6.87 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.876 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.545 HD22 ' HB2' ' A' ' 56' ' ' ARG . 9.7 mt -39.98 -46.99 2.18 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.565 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.492 HG23 HD13 ' A' ' 59' ' ' LEU . 4.2 t -69.33 -61.13 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.079 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.028 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.401 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -46.03 -22.73 0.23 Allowed 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 118.888 -1.125 . . . . 0.0 109.576 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.467 ' N ' ' C ' ' A' ' 30' ' ' VAL . 28.8 mtp -91.17 92.96 8.9 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.453 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 37' ' ' LEU . 1.6 t -53.01 176.25 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.889 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 t -53.69 -62.81 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.821 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.424 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 21.1 ptt180 -50.71 -33.18 21.82 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 118.942 -1.103 . . . . 0.0 110.024 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 21.8 mt-10 -78.59 -31.83 47.38 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.614 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.547 HD22 ' HD3' ' A' ' 56' ' ' ARG . 15.9 tp -73.86 -45.26 52.14 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.62 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -54.02 -32.56 54.7 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 118.997 -1.081 . . . . 0.0 110.225 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -27.32 68.28 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.662 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.33 -30.04 14.72 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.653 -0.819 . . . . 0.0 110.757 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 44' ' ' LEU . 44.3 mt -72.46 -32.98 66.7 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.2 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -52.82 88.59 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.112 -1.035 . . . . 0.0 110.179 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.557 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 142.03 -15.08 2.59 Favored Glycine 0 C--N 1.297 -1.606 0 N-CA-C 109.309 -1.517 . . . . 0.0 109.309 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.89 HD12 HD23 ' A' ' 41' ' ' LEU . 17.6 mt -84.95 169.4 14.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.679 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.75 154.05 19.82 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.7 tptt -45.23 -58.34 3.33 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.082 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 48' ' ' GLU . 8.4 pt-20 -57.29 -26.45 60.89 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.454 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 15.6 tp10 -83.87 -25.7 30.04 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.089 -1.044 . . . . 0.0 109.878 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.534 HG13 HD22 ' A' ' 41' ' ' LEU . 1.1 mp -71.38 -37.57 65.59 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.2 mt -60.13 -60.14 3.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.972 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -48.08 -36.96 14.06 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.47 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.458 ' CD1' ' CD1' ' A' ' 44' ' ' LEU . 16.3 mt -85.12 -19.62 31.56 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.132 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -83.99 -3.47 58.02 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.279 -0.969 . . . . 0.0 110.712 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -104.35 -62.35 1.33 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.097 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.609 HH21 ' CG ' ' A' ' 26' ' ' ASP . 3.9 ttt180 -44.8 -54.2 6.61 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.843 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.547 ' HD3' HD22 ' A' ' 37' ' ' LEU . 53.2 ttp85 -46.92 -35.11 6.11 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.076 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.3 ttt-85 -76.11 -34.15 59.48 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.274 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -62.78 -37.42 86.58 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.785 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.492 HD13 HG23 ' A' ' 30' ' ' VAL . 27.9 mt -66.03 -46.3 78.36 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.29 -0.964 . . . . 0.0 110.604 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -55.0 -17.47 3.81 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.242 -0.983 . . . . 0.0 110.566 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -95.26 -40.38 9.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.958 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.585 ' CG ' ' H ' ' A' ' 63' ' ' GLY . 40.0 ttp85 -64.14 178.74 0.64 Allowed 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.989 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.585 ' H ' ' CG ' ' A' ' 62' ' ' ARG . . . -44.09 -39.1 5.07 Favored Glycine 0 N--CA 1.492 2.394 0 C-N-CA 119.444 -1.36 . . . . 0.0 110.114 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--N 1.304 -1.395 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.508 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.403 0.62 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 p -69.54 156.29 39.13 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.051 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.31 -35.6 72.11 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.489 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.493 ' H ' ' CD ' ' A' ' 27' ' ' GLU . 3.9 mp0 -63.6 -27.04 68.96 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.282 -0.967 . . . . 0.0 110.506 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' VAL . 3.0 mt-10 -78.13 -49.45 13.86 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.059 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 29' ' ' LEU . 12.1 mt -37.41 -24.85 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.943 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -99.08 -59.06 3.47 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.345 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.56 -45.0 9.18 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.761 -1.176 . . . . 0.0 109.119 179.908 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.435 ' O ' ' CG ' ' A' ' 32' ' ' MET . 2.7 ptt? -92.31 120.64 33.04 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.111 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.7 p -77.31 -165.55 0.6 Allowed 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.636 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.4 t -56.16 -49.83 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.789 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.419 ' H ' ' HG2' ' A' ' 35' ' ' ARG . 21.5 mmm180 -44.37 -51.49 8.51 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.248 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 36' ' ' GLU . 2.6 mp0 -71.97 -30.12 64.94 Favored 'General case' 0 C--N 1.295 -1.799 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.452 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.402 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 2.6 tt -65.82 -45.35 82.62 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.959 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -58.71 -14.94 9.84 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.056 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -15.51 44.26 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.788 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.567 ' NE2' HD13 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -99.25 -46.3 5.58 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.525 -179.835 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.711 HD12 ' N ' ' A' ' 42' ' ' ARG . 0.3 OUTLIER -66.55 5.63 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.496 -179.861 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.711 ' N ' HD12 ' A' ' 41' ' ' LEU . 9.8 mtp85 -44.9 99.24 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.733 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 107.42 8.62 30.57 Favored Glycine 0 N--CA 1.483 1.813 0 C-N-CA 119.926 -1.13 . . . . 0.0 111.832 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.576 HD12 ' CB ' ' A' ' 41' ' ' LEU . 19.6 mt -84.21 151.4 24.86 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 117.437 -1.705 . . . . 0.0 110.823 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.449 ' OG ' ' OE2' ' A' ' 47' ' ' GLU . 33.7 t -78.54 171.05 15.68 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.631 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -59.87 -40.98 90.51 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.785 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.725 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -79.49 -16.98 55.12 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.707 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.565 ' HG2' HD22 ' A' ' 44' ' ' LEU . 18.2 tt0 -89.73 -20.34 23.69 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.298 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 48.6 mt -82.89 -35.36 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.593 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.273 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.239 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -52.76 -50.47 63.43 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.09 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.567 HD13 ' NE2' ' A' ' 40' ' ' HIS . 27.8 mt -67.61 -20.07 65.31 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.917 -1.113 . . . . 0.0 110.387 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.26 -19.94 38.58 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.658 -0.817 . . . . 0.0 110.436 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -76.62 -59.1 2.91 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.652 -0.819 . . . . 0.0 111.034 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.9 mmt-85 -55.57 -46.86 77.13 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.356 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.455 ' NH2' ' HE3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -51.28 -35.66 38.53 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.804 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.66 -35.77 70.44 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.717 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 17.1 m -58.88 -44.31 91.12 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.069 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.404 HD13 ' CG2' ' A' ' 30' ' ' VAL . 44.2 mt -65.95 -50.46 64.29 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.8 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.455 ' HE3' ' NH2' ' A' ' 56' ' ' ARG . 0.3 OUTLIER -56.63 -12.15 1.68 Allowed 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.735 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -96.53 -52.32 3.99 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.545 -0.862 . . . . 0.0 111.212 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.421 HH21 ' HB3' ' A' ' 62' ' ' ARG . 26.4 mtp85 -57.43 -171.77 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.548 -0.861 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.6 -46.14 5.71 Favored Glycine 0 N--CA 1.492 2.37 0 C-N-CA 119.592 -1.289 . . . . 0.0 110.43 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.394 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.379 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.463 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 121.384 0.612 . . . . 0.0 110.184 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -170.51 0.54 Allowed 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.711 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.525 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -80.5 -53.84 6.21 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.234 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 64' ' ' TYR . 14.2 mt-10 -58.59 -13.75 6.51 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 118.917 -1.113 . . . . 0.0 109.446 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.411 ' C ' ' N ' ' A' ' 30' ' ' VAL . 28.4 mm-40 -79.79 -49.03 12.6 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.523 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 28' ' ' GLU . 46.5 mt -41.61 -30.41 0.22 Allowed 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.117 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.507 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -83.33 -61.86 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.338 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.68 -29.92 2.11 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.615 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 3.1 mtp -90.7 95.57 10.21 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.615 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 33.2 t -44.04 146.83 0.57 Allowed 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.712 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.465 ' H ' HG23 ' A' ' 34' ' ' VAL . 2.0 t -41.37 -47.99 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.936 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -53.08 -41.82 65.27 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.902 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.524 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 1.3 mp0 -73.73 -22.01 60.03 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 119.141 -1.024 . . . . 0.0 109.584 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.438 ' C ' ' N ' ' A' ' 39' ' ' GLN . 13.4 tp -79.31 -51.28 9.65 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.126 -1.03 . . . . 0.0 108.908 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -53.26 -19.26 3.01 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.025 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.438 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -68.91 -42.76 76.42 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.52 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.455 ' CG ' ' N ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -75.3 -47.04 29.69 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.069 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 1.009 HD23 HD12 ' A' ' 44' ' ' LEU . 27.9 mt -42.66 -29.68 0.32 Allowed 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.087 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -45.96 95.62 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.577 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 133.46 -13.94 4.82 Favored Glycine 0 N--CA 1.484 1.838 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 1.009 HD12 HD23 ' A' ' 41' ' ' LEU . 16.4 mt -91.44 127.77 37.02 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.069 -1.052 . . . . 0.0 110.818 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.1 m -47.87 165.01 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.524 -0.871 . . . . 0.0 110.836 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.561 ' O ' HD13 ' A' ' 50' ' ' ILE . 7.3 pttm -61.26 -20.52 62.95 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.001 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -85.79 -32.76 21.63 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.859 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.06 -13.35 59.82 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.079 -1.049 . . . . 0.0 109.984 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mt -81.78 -36.6 14.47 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.023 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 46' ' ' LYS . 1.5 mp -69.78 -33.75 57.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.69 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -64.62 -27.47 68.96 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 mp -93.53 -27.3 16.72 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.257 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -71.91 5.66 2.5 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.302 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -102.56 -64.51 1.06 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 119.831 -0.747 . . . . 0.0 111.204 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 58' ' ' THR . 38.2 mtt85 -50.86 -50.03 57.72 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.058 -1.057 . . . . 0.0 110.994 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.423 HH21 ' CG2' ' A' ' 34' ' ' VAL . 0.8 OUTLIER -48.13 -33.24 7.99 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 118.971 -1.092 . . . . 0.0 110.542 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -79.3 -22.55 44.47 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.867 -1.133 . . . . 0.0 110.334 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.436 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.8 m -79.59 -42.28 25.33 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.258 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.507 HD13 ' CG2' ' A' ' 30' ' ' VAL . 27.0 mt -58.84 -54.6 45.24 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.555 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -45.35 -22.18 0.12 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.264 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.412 ' N ' ' C ' ' A' ' 59' ' ' LEU . 27.2 t-20 -100.31 -45.9 5.44 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 119.637 -0.825 . . . . 0.0 111.906 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.505 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 11.0 ttt180 -53.37 176.53 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.23 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.505 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.8 -33.3 1.07 Allowed Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.685 -1.245 . . . . 0.0 110.318 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 27' ' ' GLU . 3.0 t80 . . . . . 0 C--N 1.306 -1.298 0 C-N-CA 119.316 -0.953 . . . . 0.0 110.319 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 121.417 0.627 . . . . 0.0 110.112 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.1 p -59.27 178.18 0.15 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.244 -0.982 . . . . 0.0 110.909 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -69.37 -33.72 73.47 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.09 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.613 ' N ' ' CD ' ' A' ' 27' ' ' GLU . 4.0 mp0 -63.5 -53.84 45.71 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.8 -1.16 . . . . 0.0 109.318 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.471 ' HB3' ' SD ' ' A' ' 32' ' ' MET . 21.9 mt-10 -45.51 -48.68 14.13 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.368 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.509 HD22 ' HB2' ' A' ' 56' ' ' ARG . 6.5 mt -44.91 -35.35 2.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.943 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.556 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.3 t -99.87 -53.68 7.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.112 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.77 -26.16 0.23 Allowed 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.661 -1.216 . . . . 0.0 109.396 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.471 ' SD ' ' HB3' ' A' ' 28' ' ' GLU . 28.5 mtp -90.39 104.35 16.94 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.629 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 13.8 t -47.51 -96.16 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.24 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.419 ' N ' ' OG ' ' A' ' 33' ' ' SER . 47.8 t -138.04 -30.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.033 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -71.82 -52.77 15.84 Favored 'General case' 0 C--N 1.3 -1.578 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.403 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -66.2 -30.56 71.04 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.169 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD11 ' CD ' ' A' ' 56' ' ' ARG . 1.3 tt -73.99 -51.44 15.92 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -54.72 -16.8 2.78 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.8 OUTLIER -77.03 -39.22 50.97 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.337 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -38.97 34.94 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.92 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.593 HD23 HD12 ' A' ' 44' ' ' LEU . 16.2 mt -48.14 -30.4 4.53 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.024 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.523 ' HE ' ' HA ' ' A' ' 42' ' ' ARG . 15.0 mmm-85 -58.61 86.13 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.823 -1.151 . . . . 0.0 110.001 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 152.06 -13.11 0.73 Allowed Glycine 0 C--N 1.292 -1.893 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.593 HD12 HD23 ' A' ' 41' ' ' LEU . 13.6 mt -94.89 123.14 38.19 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.575 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 48' ' ' GLU . 94.0 p -66.86 155.61 37.91 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.338 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -43.82 -29.27 0.52 Allowed 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.67 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -83.56 -31.64 26.26 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.623 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 45' ' ' SER . 0.0 OUTLIER -81.71 -16.86 49.83 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.503 HG12 HD22 ' A' ' 41' ' ' LEU . 21.9 mt -81.63 -35.97 14.13 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.044 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -72.85 -50.06 35.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.657 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -65.89 -15.51 63.01 Favored 'General case' 0 C--N 1.296 -1.72 0 C-N-CA 119.291 -0.964 . . . . 0.0 110.297 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.848 HD13 ' C ' ' A' ' 52' ' ' LEU . 3.0 tm? -101.02 -51.97 3.4 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.188 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.445 ' N ' HD13 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -56.5 -6.46 0.3 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.62 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.5 tt0 -72.02 -71.65 0.27 Allowed 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.46 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.3 -51.49 6.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.022 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.509 ' HB2' HD22 ' A' ' 29' ' ' LEU . 64.7 ttp85 -42.58 -36.82 1.48 Allowed 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.187 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.1 ttm-85 -72.52 -31.4 65.3 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.384 -0.926 . . . . 0.0 110.544 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.524 ' N ' ' O ' ' A' ' 55' ' ' ARG . 21.9 m -67.98 -33.26 74.31 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.767 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 30' ' ' VAL . 45.6 mt -66.03 -49.75 66.61 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.122 -1.031 . . . . 0.0 110.416 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.3 mmtt -52.48 -15.67 0.72 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -93.33 -50.48 5.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.563 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -51.17 171.72 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.153 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.66 -29.88 0.83 Allowed Glycine 0 N--CA 1.492 2.419 0 C-N-CA 119.677 -1.249 . . . . 0.0 110.662 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--N 1.302 -1.475 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.736 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.519 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.3 0.572 . . . . 0.0 110.575 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.467 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -83.64 176.06 9.27 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.287 -0.965 . . . . 0.0 110.458 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.33 -47.22 79.21 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.374 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -43.02 97.13 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 118.859 -1.136 . . . . 0.0 109.355 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HB2' ' N ' ' A' ' 25' ' ' THR . 12.7 mm-40 -55.11 -44.74 75.23 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.649 -0.821 . . . . 0.0 111.367 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 14.2 mt -47.53 -34.02 7.09 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.422 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.707 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.7 t -94.13 -56.35 5.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 119.555 -0.858 . . . . 0.0 111.828 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.96 -29.66 0.87 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.002 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.481 ' SD ' ' HA ' ' A' ' 29' ' ' LEU . 12.8 ptm -92.42 120.74 33.22 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.266 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 78.1 p -63.87 -145.16 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.995 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.8 t -92.69 -42.69 13.44 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.966 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -51.6 -45.23 63.11 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.949 -1.101 . . . . 0.0 110.117 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -73.23 -28.18 62.02 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.947 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.518 HD21 HH22 ' A' ' 56' ' ' ARG . 9.2 tp -72.68 -43.7 62.76 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.628 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 -56.27 -18.04 9.36 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.01 -1.076 . . . . 0.0 109.958 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -26.72 43.36 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.388 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.4 ' O ' ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -96.7 -36.97 10.5 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.692 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 43' ' ' GLY . 12.1 mt -42.28 -36.82 1.33 Allowed 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.016 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -59.46 84.37 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 119.054 -1.058 . . . . 0.0 110.053 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 156.76 -14.48 0.34 Allowed Glycine 0 C--N 1.293 -1.812 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.602 ' CD1' HD22 ' A' ' 52' ' ' LEU . 5.1 mt -96.94 129.23 44.42 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.64 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 48' ' ' GLU . 2.4 t -73.35 157.72 36.42 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.233 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -44.33 -40.0 5.0 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.228 -0.989 . . . . 0.0 110.767 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.62 -14.06 57.18 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.634 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.513 ' N ' ' O ' ' A' ' 45' ' ' SER . 25.9 tp10 -90.46 -25.25 20.42 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.462 -0.895 . . . . 0.0 109.832 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 32.1 mt -78.42 -22.36 13.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.091 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.463 HG22 ' N ' ' A' ' 51' ' ' GLN . 9.9 mt -71.74 -62.21 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.318 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.463 ' N ' HG22 ' A' ' 50' ' ' ILE . 2.8 pt20 -50.64 -31.85 17.33 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.602 HD22 ' CD1' ' A' ' 44' ' ' LEU . 2.1 tp -75.15 -39.4 60.43 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.613 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.453 ' HD3' ' NH2' ' A' ' 56' ' ' ARG . 37.0 mmtt -62.08 -3.55 1.3 Allowed 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.482 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.433 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.7 tt0 -88.09 -75.09 0.43 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.957 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.474 ' HE ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -49.14 -45.82 44.24 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.466 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.518 HH22 HD21 ' A' ' 37' ' ' LEU . 5.1 tmm_? -53.41 -38.87 63.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.951 -1.1 . . . . 0.0 109.59 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -74.64 -34.9 62.85 Favored 'General case' 0 C--N 1.304 -1.376 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.286 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -61.18 -34.51 75.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 119.026 -1.07 . . . . 0.0 110.155 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.707 ' HB3' HG21 ' A' ' 30' ' ' VAL . 37.8 mt -69.05 -34.27 74.9 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.354 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -70.73 -9.7 57.82 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.581 -0.848 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.73 -56.99 2.34 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.665 -0.814 . . . . 0.0 111.674 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 ttt-85 -52.72 176.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -40.89 -30.96 0.4 Allowed Glycine 0 N--CA 1.494 2.541 0 C-N-CA 119.752 -1.213 . . . . 0.0 110.408 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 C--N 1.303 -1.428 0 C-N-CA 119.339 -0.944 . . . . 0.0 110.358 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.508 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 121.091 0.472 . . . . 0.0 110.407 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.419 ' H ' HG23 ' A' ' 25' ' ' THR . 44.7 p -55.81 179.87 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.881 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -71.53 -32.32 68.02 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 118.984 -1.087 . . . . 0.0 110.311 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.431 ' H ' ' HG3' ' A' ' 27' ' ' GLU . 19.0 mt-10 -62.43 -20.73 64.79 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -87.07 -41.71 13.62 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.119 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 56' ' ' ARG . 6.5 mt -41.4 -34.84 0.58 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.28 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.547 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -85.4 -61.7 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.711 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.923 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -26.93 0.82 Allowed 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.001 -1.08 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.5 mtp -90.3 92.1 8.78 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.979 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 34' ' ' VAL . 74.6 p -46.99 162.78 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.404 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 34' ' ' VAL . 21.5 t -39.9 -57.61 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.152 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.64 30.23 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.432 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -60.19 -39.36 86.26 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.172 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.4 -49.43 60.09 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.521 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.24 -14.22 2.66 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.545 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -84.17 -33.52 24.19 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.394 -0.923 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.531 ' O ' ' N ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -85.76 -36.59 20.04 Favored 'General case' 0 C--N 1.305 -1.35 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.873 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.708 HD23 HD12 ' A' ' 44' ' ' LEU . 32.8 mt -47.13 -12.14 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.209 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 40' ' ' HIS . 10.7 mmm180 -70.86 31.81 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.512 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.607 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -152.49 4.31 0.4 Allowed Glycine 0 C--N 1.294 -1.791 0 N-CA-C 109.261 -1.535 . . . . 0.0 109.261 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.708 HD12 HD23 ' A' ' 41' ' ' LEU . 15.2 mt -106.04 165.64 11.07 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.46 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.448 ' O ' ' N ' ' A' ' 49' ' ' ILE . 1.2 m -96.36 156.32 16.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.749 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -42.91 -46.04 5.21 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.124 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -71.13 -36.58 72.17 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -79.91 -11.34 59.81 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.093 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.448 ' N ' ' O ' ' A' ' 45' ' ' SER . 45.6 mt -90.49 -40.95 13.18 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.693 -0.803 . . . . 0.0 110.675 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -58.13 -56.93 12.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.124 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -51.05 -29.06 11.75 Favored 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.776 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.416 HD22 ' CD1' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -78.63 -35.25 45.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.937 -1.105 . . . . 0.0 111.343 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.4 mttt -59.3 -21.67 60.05 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.406 -0.918 . . . . 0.0 111.526 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.421 ' O ' ' N ' ' A' ' 57' ' ' ARG . 8.7 tt0 -98.88 -69.8 0.75 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.524 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.2 OUTLIER -40.33 -50.9 2.81 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.214 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.535 ' HB2' HD22 ' A' ' 29' ' ' LEU . 1.0 OUTLIER -46.95 -36.03 7.2 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 118.79 -1.164 . . . . 0.0 109.927 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.447 ' HD2' ' NH1' ' A' ' 56' ' ' ARG . 5.4 tpt85 -77.01 -18.94 57.85 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.474 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.522 ' N ' ' O ' ' A' ' 55' ' ' ARG . 3.3 m -82.64 -34.62 27.46 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.02 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.547 HD13 ' CG2' ' A' ' 30' ' ' VAL . 15.3 mt -51.95 -51.81 54.54 Favored 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.895 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -49.14 -17.97 0.28 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.992 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 59' ' ' LEU . 66.1 m-20 -106.14 -35.24 7.28 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.007 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.498 ' NE ' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -62.45 -169.64 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.505 -0.878 . . . . 0.0 110.948 -179.969 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.498 ' H ' ' NE ' ' A' ' 62' ' ' ARG . . . -43.86 -56.36 5.14 Favored Glycine 0 N--CA 1.491 2.326 0 C-N-CA 119.504 -1.331 . . . . 0.0 110.696 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.486 1.347 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.192 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.492 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.391 0.615 . . . . 0.0 109.98 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.7 p -63.64 -178.4 0.29 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.735 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -75.26 -36.13 61.3 Favored 'General case' 0 C--N 1.3 -1.587 0 C-N-CA 119.306 -0.957 . . . . 0.0 110.286 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.625 ' OE1' ' CE1' ' A' ' 64' ' ' TYR . 18.2 mm-40 -68.91 -6.87 29.99 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.935 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -90.34 -49.98 6.22 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.444 HD23 HD13 ' A' ' 37' ' ' LEU . 62.5 mt -43.05 -37.73 2.05 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.451 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.51 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.7 t -76.96 -55.33 11.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.177 -1.009 . . . . 0.0 110.525 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -48.52 -29.35 4.1 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.467 -1.293 . . . . 0.0 108.648 179.805 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 58.3 mtp -90.84 104.22 16.83 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.159 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m -46.65 -92.78 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.827 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.89 -30.4 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 C-N-CA 119.586 -0.846 . . . . 0.0 109.846 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -74.8 -36.68 62.48 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.308 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.92 -26.43 48.99 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.473 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.444 HD13 HD23 ' A' ' 29' ' ' LEU . 23.1 tp -79.2 -46.23 18.29 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.525 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -68.05 -8.54 38.66 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.664 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.532 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 1.8 mm-40 -80.83 -24.9 38.12 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.033 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.47 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -104.87 -30.11 10.07 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.369 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.624 HD23 HD12 ' A' ' 44' ' ' LEU . 17.2 mt -57.93 -37.33 73.88 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.585 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -55.51 -0.27 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.813 -1.155 . . . . 0.0 110.936 -179.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.613 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -100.37 -9.87 46.29 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.624 HD12 HD23 ' A' ' 41' ' ' LEU . 67.0 mt -98.5 178.11 5.13 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.647 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.612 ' OG ' ' N ' ' A' ' 46' ' ' LYS . 28.7 t -79.51 -170.08 2.18 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.319 -0.952 . . . . 0.0 110.249 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.612 ' N ' ' OG ' ' A' ' 45' ' ' SER . 8.7 mtpp -79.78 -38.62 32.72 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.768 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.15 -25.17 51.69 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.462 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.437 ' O ' HD23 ' A' ' 52' ' ' LEU . 46.3 mm-40 -78.41 -17.2 56.73 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.369 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.413 HD12 ' O ' ' A' ' 45' ' ' SER . 35.4 mt -86.12 -27.67 6.15 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.345 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.896 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.5 HG22 ' N ' ' A' ' 51' ' ' GLN . 12.4 mt -66.16 -63.86 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.5 ' N ' HG22 ' A' ' 50' ' ' ILE . 18.2 mt-30 -57.43 -27.92 62.83 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.54 -0.864 . . . . 0.0 111.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 48' ' ' GLU . 3.4 mm? -76.89 -28.65 55.43 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.925 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -37.68 68.59 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.587 -0.845 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -79.04 -38.4 36.64 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.196 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 58' ' ' THR . 7.1 ttt180 -56.17 -55.68 30.13 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.484 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.491 ' C ' ' CD ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -46.25 -41.34 12.82 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 118.946 -1.102 . . . . 0.0 109.526 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -66.63 -34.27 77.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.555 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.411 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.1 m -65.96 -38.33 88.29 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.544 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.51 HD13 ' CG2' ' A' ' 30' ' ' VAL . 17.2 mt -58.14 -48.93 78.74 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.067 -1.053 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.83 -23.61 0.29 Allowed 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.254 -0.978 . . . . 0.0 110.56 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 59' ' ' LEU . 2.1 t30 -98.87 -37.33 9.47 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.167 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.7 ttt-85 -59.51 178.61 0.14 Allowed 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.976 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.89 -45.46 5.9 Favored Glycine 0 N--CA 1.493 2.439 0 C-N-CA 119.624 -1.274 . . . . 0.0 110.258 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.625 ' CE1' ' OE1' ' A' ' 27' ' ' GLU . 5.1 t80 . . . . . 0 C--N 1.302 -1.492 0 C-N-CA 119.581 -0.848 . . . . 0.0 110.451 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.525 HD11 ' SD ' ' A' ' 32' ' ' MET . 11.0 tp . . . . . 0 C--O 1.215 -0.711 0 CA-C-O 121.356 0.598 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.2 p -62.94 177.99 0.51 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 118.557 -1.257 . . . . 0.0 110.066 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.22 -28.06 59.8 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.359 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.63 -18.09 63.57 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.94 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -90.2 -42.55 10.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.394 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.483 ' HA ' HD23 ' A' ' 29' ' ' LEU . 14.4 mt -42.62 -35.75 1.19 Allowed 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.065 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 30' ' ' VAL . 1.6 t -82.06 -61.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.464 -0.894 . . . . 0.0 110.873 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.33 -24.3 0.47 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 118.863 -1.135 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.525 ' SD ' HD11 ' A' ' 24' ' ' LEU . 15.0 mtp -90.31 91.41 8.48 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.827 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 40.4 t -47.64 164.62 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.95 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.3 t -41.63 -56.57 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.095 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.401 ' HE ' ' HB2' ' A' ' 35' ' ' ARG . 11.0 tpp180 -52.63 -46.79 67.24 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.474 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.97 -43.37 98.97 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.146 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.78 -45.7 77.62 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.869 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -57.86 -22.84 50.1 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.193 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.3 -24.93 59.3 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.756 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.477 ' CD2' HD22 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -98.07 -19.43 17.97 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.589 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.652 ' C ' ' H ' ' A' ' 43' ' ' GLY . 30.9 mt -76.4 -23.25 54.03 Favored 'General case' 0 C--N 1.304 -1.412 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.702 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 -69.28 27.96 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.701 -1.2 . . . . 0.0 110.66 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.652 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -139.44 -3.08 1.66 Allowed Glycine 0 N--CA 1.479 1.555 0 N-CA-C 109.028 -1.629 . . . . 0.0 109.028 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.45 ' CD1' HD12 ' A' ' 52' ' ' LEU . 22.4 mt -103.03 178.75 4.47 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.991 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.4 t -90.88 153.4 20.23 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.658 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -48.73 -42.48 35.4 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.043 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.505 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 1.8 mp0 -75.85 -23.93 55.73 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.231 -0.988 . . . . 0.0 110.773 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.438 ' HG3' HD13 ' A' ' 44' ' ' LEU . 25.1 tp10 -82.12 -19.37 40.22 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.017 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.486 HG22 HD12 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -76.06 -32.16 22.71 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 C-N-CA 119.536 -0.865 . . . . 0.0 109.696 179.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.486 HD12 HG22 ' A' ' 49' ' ' ILE . 1.5 mp -70.3 -32.61 51.12 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 C-N-CA 119.659 -0.816 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -65.99 -39.04 89.98 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.043 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 44' ' ' LEU . 93.1 mt -86.33 -34.12 20.38 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.418 -0.913 . . . . 0.0 111.253 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -62.7 -12.99 27.15 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.237 -0.985 . . . . 0.0 110.791 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.04 -68.64 0.79 Allowed 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -48.47 -47.96 38.12 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.03 -1.068 . . . . 0.0 110.386 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -47.75 -42.91 26.57 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.073 -1.051 . . . . 0.0 109.959 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -68.9 -29.53 67.82 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.284 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -66.05 -37.69 86.48 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.3 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.439 HD13 ' CG2' ' A' ' 30' ' ' VAL . 41.4 mt -66.27 -53.21 39.52 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.178 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -57.6 -14.01 4.7 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.446 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -90.13 -62.02 1.56 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.423 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 63' ' ' GLY . 10.1 ptp180 -52.4 176.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.729 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -37.8 -42.7 1.11 Allowed Glycine 0 N--CA 1.498 2.793 0 C-N-CA 120.182 -1.009 . . . . 0.0 111.009 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.304 -1.41 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.49 179.974 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 24' ' ' LEU . 13.4 tp . . . . . 0 CA--C 1.491 -1.299 0 CA-C-O 121.69 0.757 . . . . 0.0 112.109 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -52.21 171.31 0.05 Allowed 'General case' 0 C--N 1.283 -2.291 0 C-N-CA 118.714 -1.194 . . . . 0.0 110.637 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.18 -28.37 64.19 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.338 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -71.24 -11.55 60.98 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.73 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -89.37 -45.21 9.64 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.21 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.1 mt -41.27 -31.55 0.23 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.615 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.437 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.4 t -85.75 -61.27 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.169 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -27.75 1.16 Allowed 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 118.934 -1.106 . . . . 0.0 110.247 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.9 mtp -90.24 91.9 8.7 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.0 t -51.04 171.2 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.829 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 77.3 t -46.09 -64.41 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 119.434 -0.907 . . . . 0.0 110.98 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.413 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 27.2 ptt-85 -47.38 -42.16 21.26 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.933 -1.107 . . . . 0.0 110.207 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 35' ' ' ARG . 9.3 tt0 -68.94 -40.01 79.21 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.875 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.465 HD22 ' CD ' ' A' ' 56' ' ' ARG . 15.1 tp -67.52 -43.1 81.64 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.446 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -49.49 -34.68 17.64 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.015 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -41.17 92.67 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.27 -0.972 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.03 -38.02 57.7 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.357 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.916 HD23 HD12 ' A' ' 44' ' ' LEU . 41.6 mt -62.8 -19.31 63.93 Favored 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.643 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.85 77.89 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.149 -1.02 . . . . 0.0 110.124 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 153.84 -10.11 0.48 Allowed Glycine 0 C--N 1.295 -1.708 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.916 HD12 HD23 ' A' ' 41' ' ' LEU . 15.2 mt -92.71 151.25 20.17 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.692 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -75.37 152.3 38.09 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.779 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.506 ' HA ' HD12 ' A' ' 49' ' ' ILE . 14.6 ptpt -45.17 -41.88 8.58 Favored 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.909 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.449 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 11.5 mt-10 -75.9 -27.68 57.79 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.572 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -80.19 -19.09 47.88 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.092 -1.043 . . . . 0.0 109.91 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.537 HG23 HD13 ' A' ' 41' ' ' LEU . 8.6 mt -78.99 -33.17 15.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 C-N-CA 119.416 -0.914 . . . . 0.0 109.608 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.453 HG22 ' N ' ' A' ' 51' ' ' GLN . 12.4 mt -62.35 -62.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.419 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.453 ' N ' HG22 ' A' ' 50' ' ' ILE . 71.0 mt-30 -48.03 -30.32 4.28 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.63 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.499 ' HA ' HD22 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -68.36 -34.04 75.37 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.471 179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HD3' ' HE ' ' A' ' 56' ' ' ARG . 24.6 mmtp -77.95 -5.2 50.43 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.728 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.456 ' O ' ' N ' ' A' ' 57' ' ' ARG . 7.2 tt0 -76.03 -85.18 0.05 Allowed 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.348 -0.941 . . . . 0.0 111.031 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.521 ' H ' ' HD2' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -45.35 -37.77 5.23 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 119.062 -1.055 . . . . 0.0 110.497 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.538 ' HE ' ' HD3' ' A' ' 53' ' ' LYS . 42.5 ttp85 -57.87 -31.37 66.63 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.113 -1.035 . . . . 0.0 109.719 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' GLN . 22.1 ttp180 -75.91 -30.75 58.88 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.265 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -66.85 -37.73 85.02 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.527 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.437 HD13 ' CG2' ' A' ' 30' ' ' VAL . 39.6 mt -67.55 -51.87 45.56 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.578 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.406 ' HZ3' ' HB3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.31 -14.85 5.0 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.221 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -88.41 -63.62 1.27 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.426 -0.91 . . . . 0.0 112.351 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 64' ' ' TYR . 17.7 ptm180 -48.81 169.5 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.508 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -38.16 -31.24 0.1 OUTLIER Glycine 0 N--CA 1.497 2.75 0 C-N-CA 120.035 -1.079 . . . . 0.0 110.542 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.445 ' N ' ' O ' ' A' ' 62' ' ' ARG . 3.9 t80 . . . . . 0 C--N 1.302 -1.464 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.067 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.427 ' HA ' HD12 ' A' ' 24' ' ' LEU . 1.1 tp . . . . . 0 C--O 1.217 -0.658 0 CA-C-O 121.919 0.866 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.496 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -70.95 174.96 5.52 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.104 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -52.09 -50.33 61.82 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.161 -1.015 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 1.7 mp0 -65.69 -29.31 69.84 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.283 -0.967 . . . . 0.0 111.1 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.496 ' HB2' ' N ' ' A' ' 25' ' ' THR . 8.8 mt-10 -72.42 -35.85 68.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.203 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' A' ' 29' ' ' LEU . 49.0 mt -59.76 -44.58 93.79 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.422 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.477 ' C ' ' N ' ' A' ' 32' ' ' MET . 3.0 t -71.44 -49.66 45.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.83 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.285 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.46 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.47 -28.57 0.37 Allowed 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.076 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.477 ' N ' ' C ' ' A' ' 30' ' ' VAL . 30.4 mtp -92.4 113.13 25.32 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.577 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.7 t -49.23 -95.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.744 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.426 HG12 ' ND2' ' A' ' 38' ' ' ASN . 6.6 t -147.06 -27.49 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.834 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.4 ' HG2' ' H ' ' A' ' 35' ' ' ARG . 9.2 ptt-85 -74.03 -40.27 62.98 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.422 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -71.98 -31.29 66.11 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.279 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 20.4 tp -72.53 -51.64 19.07 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.466 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.426 ' ND2' HG12 ' A' ' 34' ' ' VAL . 98.4 m-20 -61.03 -14.44 23.34 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.68 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.58 -39.1 53.67 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.861 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.87 -26.46 22.76 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.793 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.649 HD23 HD12 ' A' ' 44' ' ' LEU . 15.8 mt -58.16 -32.88 68.62 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.334 -0.946 . . . . 0.0 111.059 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -64.2 76.68 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 118.841 -1.143 . . . . 0.0 110.053 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 167.07 -13.89 0.07 OUTLIER Glycine 0 C--N 1.294 -1.775 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.649 HD12 HD23 ' A' ' 41' ' ' LEU . 20.3 mt -87.86 170.92 10.76 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.505 ' H ' ' HB3' ' A' ' 48' ' ' GLU . 15.7 m -94.81 165.67 12.36 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.754 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -50.2 -56.83 9.44 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.22 -23.4 66.42 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 119.4 -0.92 . . . . 0.0 111.24 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.505 ' HB3' ' H ' ' A' ' 45' ' ' SER . 42.0 tt0 -84.96 -15.57 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.157 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.5 mt -89.94 -42.23 14.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.586 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mt -59.83 -49.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.012 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -54.4 -39.14 66.98 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.421 HD22 ' CD1' ' A' ' 44' ' ' LEU . 5.1 mp -73.52 -33.92 65.0 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.213 -0.995 . . . . 0.0 111.042 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.1 mttt -66.84 -5.4 12.18 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.43 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 55' ' ' ARG . 9.0 tp60 -96.89 -77.07 0.5 Allowed 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.767 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' N ' ' A' ' 58' ' ' THR . 1.2 mmp_? -42.4 -58.09 2.35 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.166 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -47.48 -38.3 13.47 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 118.782 -1.167 . . . . 0.0 109.888 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -76.7 -25.06 53.19 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.89 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' ARG . 37.0 m -77.38 -38.09 50.69 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.873 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.468 ' O ' ' N ' ' A' ' 61' ' ' ASN . 29.2 mt -59.17 -60.8 3.28 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.607 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.421 ' HG3' HG13 ' A' ' 30' ' ' VAL . 15.7 mtpp -43.38 -22.16 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.609 -0.837 . . . . 0.0 111.188 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 59' ' ' LEU . 25.0 t30 -93.56 -42.89 8.97 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.157 -1.017 . . . . 0.0 111.437 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -62.83 -160.9 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.308 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.22 96.36 Favored Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.623 -1.275 . . . . 0.0 110.903 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--N 1.305 -1.337 0 C-N-CA 119.133 -1.027 . . . . 0.0 110.859 -179.966 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.498 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.445 ' OG1' ' OE1' ' A' ' 28' ' ' GLU . 2.8 p -57.73 -175.03 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 118.796 -1.162 . . . . 0.0 110.771 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -69.9 -38.52 76.34 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.86 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 27' ' ' GLU . 6.0 pt-20 -61.35 -41.48 97.13 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.904 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.445 ' OE1' ' OG1' ' A' ' 25' ' ' THR . 0.3 OUTLIER -52.24 -49.85 63.19 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.578 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.474 HD21 HD11 ' A' ' 24' ' ' LEU . 57.7 mt -43.12 -41.5 3.68 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.65 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.45 ' CG2' HD13 ' A' ' 59' ' ' LEU . 2.2 t -78.66 -59.11 3.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.573 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.9 -28.56 9.89 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 118.877 -1.129 . . . . 0.0 109.435 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 34.3 mtp -91.0 96.32 10.56 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.549 -0.86 . . . . 0.0 111.078 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' N ' ' A' ' 37' ' ' LEU . 60.4 p -54.15 178.47 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.915 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 67.4 t -50.04 -61.05 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.346 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.9 ttp180 -51.01 -43.48 60.85 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.583 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -72.63 -30.97 64.78 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.208 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 33' ' ' SER . 56.2 tp -73.86 -43.65 57.94 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.411 ' O ' HD11 ' A' ' 41' ' ' LEU . 68.3 m-20 -65.69 -7.41 15.28 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.119 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.68 -12.83 38.38 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.762 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -98.1 -35.52 10.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.475 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.643 ' CB ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -77.94 14.21 1.18 Allowed 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 118.68 -1.208 . . . . 0.0 112.149 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.573 ' N ' HD12 ' A' ' 41' ' ' LEU . 36.2 mtp85 -51.21 90.1 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.825 -1.15 . . . . 0.0 110.776 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 128.92 4.51 5.12 Favored Glycine 0 N--CA 1.484 1.861 0 C-N-CA 119.925 -1.131 . . . . 0.0 110.72 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.643 HD12 ' CB ' ' A' ' 41' ' ' LEU . 20.9 mt -85.15 147.18 26.74 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.126 -1.43 . . . . 0.0 110.975 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.481 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 14.8 t -80.31 175.41 10.68 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.345 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.656 ' CD ' ' H ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -60.26 -38.19 82.76 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.22 -0.992 . . . . 0.0 110.746 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -82.12 -18.0 44.47 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.502 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.481 ' HB2' ' H ' ' A' ' 45' ' ' SER . 2.4 mt-10 -87.62 -23.75 24.17 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.247 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.522 HG12 HD22 ' A' ' 41' ' ' LEU . 42.0 mt -80.65 -32.28 12.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.099 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.52 -58.72 5.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.401 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -52.83 -33.64 50.33 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.514 -0.874 . . . . 0.0 110.802 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.22 -33.37 43.77 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.236 -0.985 . . . . 0.0 110.549 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -80.93 -14.64 57.8 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.369 -0.933 . . . . 0.0 110.621 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.31 -63.2 1.16 Allowed 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.449 ' O ' ' N ' ' A' ' 58' ' ' THR . 70.9 mtt180 -45.92 -50.96 14.03 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.316 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -44.48 -38.32 4.03 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.285 -0.966 . . . . 0.0 110.444 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -75.12 -31.62 61.17 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.103 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.449 ' N ' ' O ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -68.02 -38.54 82.68 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.217 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.45 HD13 ' CG2' ' A' ' 30' ' ' VAL . 25.4 mt -65.21 -43.94 89.9 Favored 'General case' 0 C--N 1.306 -1.314 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.78 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -59.62 -22.36 61.73 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -95.86 -48.02 5.9 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.526 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -57.07 -175.86 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.028 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -45.59 -46.33 12.59 Favored Glycine 0 N--CA 1.49 2.289 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.304 -1.376 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.367 -179.95 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.764 ' CD1' ' H ' ' A' ' 25' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.212 -0.886 0 CA-C-O 121.371 0.605 . . . . 0.0 110.701 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.764 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -175.81 162.0 2.6 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.634 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.562 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -71.54 -46.94 58.13 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.105 -1.038 . . . . 0.0 109.998 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -20.19 39.26 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.266 -0.974 . . . . 0.0 109.852 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' VAL . 2.4 mt-10 -77.7 -47.21 19.71 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.795 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 28' ' ' GLU . 24.1 mt -39.68 -29.77 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.64 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.485 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -89.37 -63.05 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.626 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.636 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.41 -28.86 1.48 Allowed 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.042 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 6.1 mtp -88.07 91.07 8.64 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.226 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -41.34 154.59 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.968 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -39.87 -38.29 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.054 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.457 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 34.5 ttp180 -62.45 -46.68 87.44 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.032 -1.067 . . . . 0.0 109.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.457 ' CD ' ' HE ' ' A' ' 35' ' ' ARG . 2.9 mp0 -67.67 -37.95 83.07 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.326 -0.949 . . . . 0.0 109.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.86 -46.75 77.32 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.654 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -57.24 -19.83 23.76 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.17 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.41 -35.34 35.33 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.531 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.61 -37.22 42.83 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.861 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.65 ' C ' ' H ' ' A' ' 43' ' ' GLY . 49.2 mt -54.73 -13.7 1.12 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.026 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -69.9 27.7 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.361 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.65 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -144.57 -3.16 0.73 Allowed Glycine 0 C--N 1.292 -1.896 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.1 mt -107.74 149.9 27.61 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.041 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.35 152.52 30.39 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.288 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.543 ' HA ' HD12 ' A' ' 49' ' ' ILE . 6.7 pttt -46.43 -28.16 1.29 Allowed 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.833 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -82.46 -38.86 23.36 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.635 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -77.16 -15.1 59.66 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.056 -1.058 . . . . 0.0 109.628 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 46' ' ' LYS . 57.6 mt -80.45 -39.07 18.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 C-N-CA 119.544 -0.862 . . . . 0.0 109.697 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.489 HG22 ' N ' ' A' ' 51' ' ' GLN . 9.5 mt -62.9 -62.27 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.275 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.489 ' N ' HG22 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -45.77 -28.97 1.16 Allowed 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.875 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.44 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -78.56 -41.78 31.08 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.246 -0.982 . . . . 0.0 110.898 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.5 mttp -50.25 -20.34 1.02 Allowed 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.422 ' O ' ' N ' ' A' ' 57' ' ' ARG . 37.9 tt0 -74.22 -73.13 0.24 Allowed 'General case' 0 C--N 1.301 -1.514 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.785 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 58' ' ' THR . 4.8 mmp_? -43.15 -51.64 5.87 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.591 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -45.71 -36.48 5.01 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.808 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 54' ' ' GLN . 13.0 ttt85 -71.17 -27.96 63.9 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.647 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.483 ' N ' ' O ' ' A' ' 55' ' ' ARG . 23.8 m -72.21 -42.63 65.56 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.485 HD13 ' CG2' ' A' ' 30' ' ' VAL . 36.7 mt -60.91 -57.97 10.39 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 118.733 -1.187 . . . . 0.0 110.498 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.41 -13.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.426 -0.909 . . . . 0.0 111.23 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.413 ' N ' ' C ' ' A' ' 59' ' ' LEU . 6.1 t-20 -91.94 -62.2 1.47 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 119.338 -0.945 . . . . 0.0 112.133 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 64' ' ' TYR . 7.6 ptm180 -51.61 173.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.26 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -39.06 -30.45 0.12 Allowed Glycine 0 N--CA 1.498 2.775 0 C-N-CA 119.889 -1.148 . . . . 0.0 110.462 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.436 ' N ' ' O ' ' A' ' 62' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.302 -1.486 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.158 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.675 ' CD1' ' CD2' ' A' ' 40' ' ' HIS . 6.0 mt . . . . . 0 CA--C 1.501 -0.913 0 CA-C-O 121.146 0.498 . . . . 0.0 110.683 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.503 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -58.06 -174.03 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.143 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.621 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -59.84 -56.89 16.12 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.752 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 31' ' ' THR . 6.6 mp0 -64.33 -22.57 67.0 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.51 ' O ' ' CG ' ' A' ' 32' ' ' MET . 10.3 mm-40 -83.54 -9.74 58.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.207 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 56' ' ' ARG . 13.8 mt -87.33 -24.75 24.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.434 -0.907 . . . . 0.0 111.141 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.699 HG21 ' HB3' ' A' ' 59' ' ' LEU . 6.5 t -101.95 -39.78 6.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.066 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.672 HG23 ' O ' ' A' ' 27' ' ' GLU . 0.8 OUTLIER -45.53 -46.61 14.09 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.51 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -94.44 133.72 37.73 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.052 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 83.5 p -64.72 -150.63 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.963 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -84.12 -42.35 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 119.339 -0.945 . . . . 0.0 111.302 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -56.57 -43.53 80.1 Favored 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.207 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.522 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 8.9 mp0 -70.0 -26.47 64.08 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.344 -0.943 . . . . 0.0 109.918 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 24' ' ' LEU . 36.6 tp -76.12 -54.48 6.77 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.352 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.762 HD22 ' N ' ' A' ' 38' ' ' ASN . 0.7 OUTLIER -58.89 -11.26 3.1 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.395 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 1.7 tt0 -76.24 -38.86 55.77 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.85 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.675 ' CD2' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -90.55 -37.42 13.86 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.562 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.822 HD23 HD12 ' A' ' 44' ' ' LEU . 18.0 mt -45.94 -34.68 4.09 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.519 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.6 mtp180 -49.94 91.31 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.071 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 143.92 -15.53 2.17 Favored Glycine 0 C--N 1.295 -1.74 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.822 HD12 HD23 ' A' ' 41' ' ' LEU . 18.9 mt -90.44 140.29 29.86 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 119.114 -1.035 . . . . 0.0 110.682 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -56.18 -178.24 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.565 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.526 ' O ' HD13 ' A' ' 50' ' ' ILE . 21.6 mmtt -77.25 -21.0 54.4 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -89.15 -29.47 19.31 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.921 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.39 -14.51 59.36 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.132 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.49 HG12 HD22 ' A' ' 41' ' ' LEU . 8.4 mt -83.9 -43.06 17.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.446 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.526 HD13 ' O ' ' A' ' 46' ' ' LYS . 1.5 mp -62.76 -56.97 14.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.666 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.893 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.494 ' N ' HG22 ' A' ' 50' ' ' ILE . 9.1 pt20 -51.36 -29.86 16.79 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.851 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.443 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 1.2 mp -81.11 -25.79 36.7 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.933 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -81.62 -9.17 59.73 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.016 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -81.33 -75.14 0.3 Allowed 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.032 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -44.59 -42.38 7.31 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.279 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.432 ' HB2' HD22 ' A' ' 29' ' ' LEU . 7.7 ttt-85 -50.52 -41.44 53.72 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.16 -1.016 . . . . 0.0 109.748 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.485 HH11 ' HG2' ' A' ' 57' ' ' ARG . 57.7 mmt-85 -74.96 -31.59 61.5 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.278 -0.969 . . . . 0.0 110.063 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.0 m -67.16 -38.14 84.96 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.337 -0.945 . . . . 0.0 110.409 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.699 ' HB3' HG21 ' A' ' 30' ' ' VAL . 19.3 mt -67.71 -34.33 76.65 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.639 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HZ2' ' HB3' ' A' ' 60' ' ' LYS . 10.6 mtpp -67.46 -15.17 63.52 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.54 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -97.04 -49.1 5.14 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.748 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.48 ' O ' ' N ' ' A' ' 64' ' ' TYR . 57.9 ttt-85 -51.38 169.44 0.05 Allowed 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.424 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.48 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.62 -23.45 0.11 Allowed Glycine 0 N--CA 1.493 2.456 0 C-N-CA 119.608 -1.282 . . . . 0.0 110.949 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.48 ' N ' ' O ' ' A' ' 62' ' ' ARG . 6.1 t80 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.104 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.44 ' HA ' HD12 ' A' ' 24' ' ' LEU . 1.2 tp . . . . . 0 C--O 1.216 -0.7 0 CA-C-O 122.179 0.99 . . . . 0.0 110.073 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.471 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -59.54 163.86 3.88 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.777 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.09 -41.66 26.79 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.64 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.861 ' O ' HG23 ' A' ' 31' ' ' THR . 30.2 mt-10 -70.74 -32.42 69.58 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.713 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.495 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 1.6 mp0 -66.21 -35.35 80.2 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.414 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 mt -60.25 -29.25 68.66 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.693 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.82 HG21 ' HB3' ' A' ' 59' ' ' LEU . 17.1 t -92.66 -42.78 13.5 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.167 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.844 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.861 HG23 ' O ' ' A' ' 27' ' ' GLU . 22.4 p -46.05 -37.29 6.54 Favored 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.591 -1.244 . . . . 0.0 107.803 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.6 ptm -92.92 123.84 36.47 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.856 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -66.05 -177.47 0.5 Allowed 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.019 -1.072 . . . . 0.0 110.793 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.522 ' O ' ' N ' ' A' ' 37' ' ' LEU . 44.7 t -62.23 -55.17 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.672 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -47.31 -30.02 2.88 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 118.696 -1.202 . . . . 0.0 109.432 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -85.37 -26.49 26.45 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.301 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.591 HD13 ' HE ' ' A' ' 56' ' ' ARG . 5.0 tp -74.63 -41.21 60.79 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.149 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -51.08 -37.21 44.34 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.953 -1.099 . . . . 0.0 109.484 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.21 -37.29 77.09 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.105 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.8 -45.57 16.73 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.735 HD22 HG12 ' A' ' 49' ' ' ILE . 30.5 mt -50.22 -29.11 8.75 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.486 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -52.1 88.77 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.339 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 139.7 -13.27 3.17 Favored Glycine 0 N--CA 1.481 1.678 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.2 mt -97.74 137.47 36.57 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.83 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.513 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 0.4 OUTLIER -89.34 173.25 8.48 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.584 -0.846 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.5 mmtt -45.99 -46.91 16.68 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.26 -31.78 70.55 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.981 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.513 ' HB2' ' H ' ' A' ' 45' ' ' SER . 23.9 mt-10 -83.42 -21.5 32.96 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.735 HG12 HD22 ' A' ' 41' ' ' LEU . 2.3 mt -82.42 -34.74 12.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.004 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 22.8 mt -59.49 -57.09 13.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.583 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.431 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 4.2 mm100 -42.07 -31.21 0.34 Allowed 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.168 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.5 ' C ' ' H ' ' A' ' 54' ' ' GLN . 34.2 mt -88.26 -32.86 18.3 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -64.74 4.87 0.36 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.356 -0.938 . . . . 0.0 111.008 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 52' ' ' LEU . 6.3 tt0 -99.21 -89.16 0.32 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.486 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 54' ' ' GLN . 12.4 tpt180 -43.65 -50.55 7.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.688 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.591 ' HE ' HD13 ' A' ' 37' ' ' LEU . 64.7 ttt-85 -48.98 -31.18 7.01 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.766 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 54' ' ' GLN . 0.2 OUTLIER -76.67 -32.15 57.75 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.644 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 m -69.59 -41.71 75.4 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.962 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.82 ' HB3' HG21 ' A' ' 30' ' ' VAL . 40.8 mt -70.72 -35.29 72.63 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.134 -1.026 . . . . 0.0 110.616 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -72.6 -13.22 61.33 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.583 -0.847 . . . . 0.0 111.517 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -91.55 -67.01 0.88 Allowed 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.16 -1.016 . . . . 0.0 112.155 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HG3' ' H ' ' A' ' 64' ' ' TYR . 4.0 ptm180 -51.11 173.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.49 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -36.32 -35.73 0.12 Allowed Glycine 0 N--CA 1.5 2.947 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.289 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.543 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--N 1.301 -1.514 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.424 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.824 HD11 ' SD ' ' A' ' 32' ' ' MET . 9.1 tp . . . . . 0 C--O 1.216 -0.691 0 CA-C-O 121.857 0.837 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.7 p -51.3 169.31 0.05 Allowed 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.34 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.89 -8.58 55.24 Favored 'General case' 0 C--N 1.299 -1.603 0 C-N-CA 118.897 -1.121 . . . . 0.0 110.5 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.411 ' O ' ' OG1' ' A' ' 31' ' ' THR . 18.3 mt-10 -90.17 -14.54 33.32 Favored 'General case' 0 C--N 1.295 -1.798 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.237 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' LEU . 33.6 mm-40 -90.92 -48.87 6.75 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 119.857 -0.737 . . . . 0.0 112.014 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' A' ' 28' ' ' GLU . 14.5 mt -39.66 -46.42 1.83 Allowed 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 119.819 -0.753 . . . . 0.0 111.536 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.639 HG13 ' CG ' ' A' ' 60' ' ' LYS . 12.0 t -70.78 -57.64 7.28 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.233 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -51.7 -20.22 1.98 Allowed 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 118.597 -1.241 . . . . 0.0 109.444 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.824 ' SD ' HD11 ' A' ' 24' ' ' LEU . 75.2 mtp -89.98 90.61 8.23 Favored 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.646 -0.821 . . . . 0.0 110.666 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 p -49.0 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.746 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 61.1 t -139.88 -26.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 C-N-CA 119.876 -0.73 . . . . 0.0 110.307 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.484 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -76.81 -41.29 44.96 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.781 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 4.4 tp10 -76.34 -29.96 57.44 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.431 -0.908 . . . . 0.0 109.514 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.1 tp -71.44 -43.52 66.54 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.878 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -58.47 -33.97 70.36 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.316 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -33.55 68.87 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' HD11 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -93.01 -35.48 13.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.516 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.604 HD23 HD12 ' A' ' 44' ' ' LEU . 40.4 mt -62.7 -15.58 53.4 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.135 -1.026 . . . . 0.0 110.991 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -70.34 39.76 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.958 -1.097 . . . . 0.0 110.261 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.586 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -158.72 -2.49 0.07 OUTLIER Glycine 0 C--N 1.293 -1.807 0 N-CA-C 108.793 -1.723 . . . . 0.0 108.793 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 41' ' ' LEU . 22.3 mt -107.02 157.38 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 119.831 -0.748 . . . . 0.0 110.911 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.27 -176.04 4.97 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.803 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -66.66 -39.7 88.29 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.811 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.25 -36.5 69.07 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.801 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -74.08 -19.26 60.66 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.454 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mt -80.89 -38.93 17.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.722 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.8 mt -65.31 -50.56 72.6 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.328 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.946 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -54.12 -40.84 67.71 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.288 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.449 HD22 ' CD1' ' A' ' 44' ' ' LEU . 1.7 mp -74.15 -37.49 64.02 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.293 -0.963 . . . . 0.0 110.246 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.56 -29.64 69.28 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.991 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -86.36 -45.16 11.46 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.384 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 -51.54 -61.57 2.16 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 119.256 -0.978 . . . . 0.0 109.936 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.503 ' C ' ' CD ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -47.28 -31.03 3.47 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 118.924 -1.11 . . . . 0.0 109.217 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.64 -37.96 48.88 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -60.47 -42.17 95.68 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.338 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.546 HD13 HG23 ' A' ' 30' ' ' VAL . 13.2 mt -54.83 -47.46 74.08 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.592 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.639 ' CG ' HG13 ' A' ' 30' ' ' VAL . 39.2 mtpt -71.28 4.95 2.47 Favored 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.286 -0.966 . . . . 0.0 110.689 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -139.65 19.16 2.52 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.477 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 63' ' ' GLY . 35.3 ttt180 -137.1 -111.24 0.18 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.121 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.46 ' N ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.87 -75.47 0.76 Allowed Glycine 0 N--CA 1.491 2.309 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.926 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--N 1.304 -1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 111.225 -179.915 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.51 ' C ' ' CD1' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.237 0.542 . . . . 0.0 109.905 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.11 149.51 27.97 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.203 -0.999 . . . . 0.0 110.559 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -48.11 -40.73 24.43 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.826 -1.149 . . . . 0.0 109.941 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.21 -24.69 63.35 Favored 'General case' 0 C--N 1.299 -1.624 0 C-N-CA 119.444 -0.903 . . . . 0.0 111.214 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.49 -40.46 29.66 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.259 -0.976 . . . . 0.0 111.061 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.513 ' HA ' HD23 ' A' ' 29' ' ' LEU . 13.9 mt -43.15 -34.27 1.06 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.593 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.551 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.6 t -85.88 -63.41 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.728 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.301 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.26 -28.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.145 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 9.0 mtp -88.23 91.59 8.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.223 -0.991 . . . . 0.0 110.507 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.506 ' O ' ' N ' ' A' ' 37' ' ' LEU . 2.6 p -55.39 -178.76 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.899 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.466 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 45.6 t -49.58 -52.68 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 111.2 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -54.72 -54.21 44.87 Favored 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.457 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -67.08 -30.3 70.29 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.415 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 33' ' ' SER . 9.7 tp -74.3 -39.89 62.62 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.173 -1.011 . . . . 0.0 110.109 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.504 HD22 ' N ' ' A' ' 38' ' ' ASN . 1.0 OUTLIER -58.98 -20.47 53.08 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.569 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -72.0 -31.14 65.94 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.53 -43.49 10.19 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.155 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.884 HD22 HD13 ' A' ' 49' ' ' ILE . 19.0 mt -45.94 -47.52 16.46 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 119.539 -0.864 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 41' ' ' LEU . 4.5 mtp85 -41.78 94.52 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.571 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 141.16 -19.45 2.68 Favored Glycine 0 C--N 1.296 -1.646 0 N-CA-C 109.065 -1.614 . . . . 0.0 109.065 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.795 HD12 HD23 ' A' ' 41' ' ' LEU . 19.3 mt -84.82 147.51 26.78 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.621 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 48' ' ' GLU . 52.8 p -76.61 151.91 36.08 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.742 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.554 ' H ' ' HD2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -45.6 -35.71 4.21 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.268 -0.973 . . . . 0.0 110.603 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -77.7 -31.14 52.17 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.283 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 45' ' ' SER . 5.8 tt0 -77.94 -20.52 52.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.041 -1.064 . . . . 0.0 109.12 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.884 HD13 HD22 ' A' ' 41' ' ' LEU . 1.6 mm -72.83 -46.46 52.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.585 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 mt -58.81 -56.02 19.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -54.8 -37.97 66.73 Favored 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.41 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.26 -39.77 65.15 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.094 -1.042 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.7 mmmp? -62.39 -11.57 16.43 Favored 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.841 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -84.48 -56.53 3.57 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.406 ' H ' ' HG2' ' A' ' 55' ' ' ARG . 15.1 mmt180 -55.52 -51.39 67.2 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.027 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -49.54 -38.12 29.55 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.995 -1.082 . . . . 0.0 109.697 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -33.55 67.18 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.983 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.464 ' O ' ' N ' ' A' ' 62' ' ' ARG . 96.0 m -64.09 -41.51 97.27 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.217 -0.993 . . . . 0.0 110.485 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.551 HD13 ' CG2' ' A' ' 30' ' ' VAL . 31.7 mt -54.49 -60.35 3.47 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.754 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp -47.57 -20.47 0.26 Allowed 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.444 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -106.25 -29.66 9.67 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.594 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' THR . 15.3 ttt180 -76.39 -147.54 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.032 -1.067 . . . . 0.0 111.483 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.456 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -57.73 -61.01 7.95 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.829 -1.176 . . . . 0.0 111.611 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--N 1.305 -1.344 0 C-N-CA 119.172 -1.011 . . . . 0.0 111.546 -179.868 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.54 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.95 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.512 ' H ' ' HG3' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -80.38 -157.36 0.15 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.131 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -76.85 -53.73 7.52 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.972 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.766 ' O ' HG23 ' A' ' 31' ' ' THR . 63.1 mt-10 -62.4 -24.28 67.31 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.206 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 25' ' ' THR . 37.1 mm-40 -63.87 -29.67 70.83 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.486 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.71 -45.72 74.29 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.696 0.76 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.809 HG21 ' HB3' ' A' ' 59' ' ' LEU . 41.4 t -78.42 -44.19 26.58 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.006 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.766 HG23 ' O ' ' A' ' 27' ' ' GLU . 6.6 p -51.09 -35.39 34.85 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 10.3 mtm -92.52 123.58 35.92 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.549 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -162.86 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.247 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.99 -48.95 36.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.944 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -61.83 -31.25 71.47 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.604 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -77.42 -36.9 52.79 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.222 -0.991 . . . . 0.0 109.928 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 tp -74.49 -42.89 58.19 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.105 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -63.23 -14.36 48.36 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.944 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.09 -32.03 64.72 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.486 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.477 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -99.09 -27.13 13.98 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.226 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.697 HD23 HD12 ' A' ' 44' ' ' LEU . 17.5 mt -54.05 -33.53 57.67 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 119.218 -0.993 . . . . 0.0 111.765 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.489 ' CB ' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -63.61 78.26 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.386 -179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 165.76 -14.61 0.08 OUTLIER Glycine 0 C--N 1.296 -1.679 0 N-CA-C 109.134 -1.586 . . . . 0.0 109.134 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.697 HD12 HD23 ' A' ' 41' ' ' LEU . 22.4 mt -88.93 152.67 21.58 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 46' ' ' LYS . 11.1 t -74.19 155.19 38.62 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.206 -0.998 . . . . 0.0 110.315 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 45' ' ' SER . 1.0 OUTLIER -41.78 -43.24 2.87 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.504 -0.878 . . . . 0.0 111.202 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.69 -48.35 72.36 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.335 -0.946 . . . . 0.0 111.103 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.3 OUTLIER -62.52 -22.62 66.43 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.698 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mm -76.01 -43.15 38.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.749 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -69.55 -40.41 79.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 C-N-CA 118.986 -1.085 . . . . 0.0 109.339 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -57.56 -49.25 76.98 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.878 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.57 ' C ' ' H ' ' A' ' 54' ' ' GLN . 6.0 mp -69.97 -42.31 73.32 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.245 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.436 ' HD2' HH21 ' A' ' 56' ' ' ARG . 0.5 OUTLIER -61.17 5.54 0.06 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.018 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 52' ' ' LEU . 30.2 tt0 -100.32 -76.34 0.56 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.291 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -42.71 -47.84 5.46 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.351 -0.94 . . . . 0.0 110.506 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.436 HH21 ' HD2' ' A' ' 53' ' ' LYS . 4.2 tmm_? -45.72 -36.22 4.84 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.206 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.651 ' CA ' ' HE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -74.82 -34.29 62.32 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.46 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.46 ' N ' ' HG3' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -77.74 -36.97 50.24 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.536 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.809 ' HB3' HG21 ' A' ' 30' ' ' VAL . 20.4 mt -62.53 -21.12 65.3 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.315 -0.954 . . . . 0.0 111.409 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.51 ' HA ' ' HZ2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -90.41 0.97 57.06 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -121.49 -33.32 3.66 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.665 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -65.94 -149.1 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.582 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.21 -27.57 73.6 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.379 -1.391 . . . . 0.0 110.369 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.9 t80 . . . . . 0 C--N 1.308 -1.237 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.949 -179.946 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.571 HD11 HD21 ' A' ' 29' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 121.312 0.577 . . . . 0.0 110.513 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.14 -174.48 3.67 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.437 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -52.43 51.05 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.355 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -56.07 -38.23 70.38 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.861 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -46.88 71.24 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.922 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.571 HD21 HD11 ' A' ' 24' ' ' LEU . 69.7 mt -47.7 -39.67 18.13 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.573 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.428 ' C ' ' N ' ' A' ' 32' ' ' MET . 2.0 t -79.25 -58.95 3.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.915 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.76 -26.66 0.69 Allowed 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.09 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.428 ' N ' ' C ' ' A' ' 30' ' ' VAL . 62.7 mtp -91.05 97.85 11.41 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.923 -1.035 . . . . 0.0 109.993 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.3 m -48.94 -94.27 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 119.821 -0.752 . . . . 0.0 111.58 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.8 t -140.58 -31.59 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.593 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.5 ptt-85 -76.86 -23.76 52.65 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.897 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.34 -31.37 18.95 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.891 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tp -74.35 -39.59 62.69 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.272 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -61.67 -14.84 34.82 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.907 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -89.99 0.04 57.32 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.496 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.42 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -113.38 -29.21 7.3 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.373 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.601 HD12 ' N ' ' A' ' 42' ' ' ARG . 0.2 OUTLIER -84.01 3.36 34.73 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.469 -1.293 . . . . 0.0 112.789 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.601 ' N ' HD12 ' A' ' 41' ' ' LEU . 5.8 mtm180 -50.86 90.68 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.999 -1.08 . . . . 0.0 110.743 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 132.65 0.37 4.44 Favored Glycine 0 N--CA 1.482 1.76 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.8 mt -89.77 124.94 35.08 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 118.719 -1.193 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.6 m -60.36 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.326 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.483 ' O ' HD13 ' A' ' 50' ' ' ILE . 3.3 tmtm? -73.88 -38.21 64.48 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.765 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.733 ' CD ' ' H ' ' A' ' 47' ' ' GLU . 9.9 pm0 -83.15 -11.62 57.75 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.044 -1.062 . . . . 0.0 110.565 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.61 -21.68 21.6 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 119.388 -0.925 . . . . 0.0 110.176 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.513 HG22 HD12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.86 -27.7 15.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 C-N-CA 119.424 -0.911 . . . . 0.0 109.627 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.513 HD12 HG22 ' A' ' 49' ' ' ILE . 1.4 mp -70.29 -33.4 54.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.534 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.422 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 10.8 mm100 -58.03 -43.09 86.58 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.563 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 52' ' ' LEU . 4.4 mm? -69.49 -35.79 75.89 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.681 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HD3' HH21 ' A' ' 56' ' ' ARG . 15.0 mmtp -64.47 -0.52 1.36 Allowed 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.416 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.0 tp60 -86.46 -79.56 0.26 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.963 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -54.08 -38.0 64.83 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.039 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.438 HH21 ' HD3' ' A' ' 53' ' ' LYS . 45.9 ttp85 -59.08 -31.27 68.74 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.013 -1.075 . . . . 0.0 109.724 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -79.43 -28.45 41.71 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.3 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.9 m -71.05 -34.72 71.5 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.294 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.415 ' HB3' HG21 ' A' ' 30' ' ' VAL . 65.3 mt -69.87 -48.61 58.1 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.163 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -63.15 -10.6 15.63 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.644 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -89.4 -62.84 1.39 Allowed 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.395 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -53.36 178.21 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.608 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.409 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -40.09 -32.49 0.39 Allowed Glycine 0 N--CA 1.495 2.599 0 C-N-CA 119.844 -1.17 . . . . 0.0 110.62 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.6 t80 . . . . . 0 C--N 1.306 -1.292 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.429 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.474 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 121.108 0.48 . . . . 0.0 110.438 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -169.47 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.761 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.678 ' HB3' HD11 ' A' ' 59' ' ' LEU . 29.2 m-20 -73.3 -58.04 3.59 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.101 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -52.67 -8.56 0.09 Allowed 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.998 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.532 ' H ' ' C ' ' A' ' 26' ' ' ASP . 2.2 mt-10 -90.57 -32.63 16.21 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.641 -0.824 . . . . 0.0 111.424 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.463 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 92.4 mt -65.45 -23.97 67.06 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.73 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.693 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.9 t -96.63 -59.92 2.93 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.006 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.264 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.463 ' CG2' ' N ' ' A' ' 32' ' ' MET . 14.6 t -41.43 -32.63 0.34 Allowed 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 118.989 -1.084 . . . . 0.0 108.688 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.515 ' SD ' ' O ' ' A' ' 28' ' ' GLU . 14.6 ptm -91.06 119.24 31.05 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.415 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 41.3 t -57.86 -174.85 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.471 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.503 ' N ' ' OG ' ' A' ' 33' ' ' SER . 48.7 t -68.97 -46.18 79.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.255 -0.978 . . . . 0.0 110.672 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -50.69 -46.39 58.78 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.174 -1.01 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.96 -25.36 63.6 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.179 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.464 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -78.94 -49.33 12.98 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.236 -0.986 . . . . 0.0 109.348 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.45 ' ND2' HG12 ' A' ' 34' ' ' VAL . 69.3 m-20 -59.6 -16.98 29.46 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.913 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -78.0 -33.46 51.25 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.361 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.461 ' C ' ' N ' ' A' ' 42' ' ' ARG . 0.7 OUTLIER -89.47 -45.16 9.63 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.364 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.617 HD13 HG23 ' A' ' 49' ' ' ILE . 42.4 mt -46.26 -18.9 0.06 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.703 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' N ' ' C ' ' A' ' 40' ' ' HIS . 1.4 ttp180 -56.35 -10.03 0.82 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.418 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.43 ' N ' ' C ' ' A' ' 41' ' ' LEU . . . -103.76 -1.78 46.17 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.8 mt -110.31 153.51 24.78 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 119.595 -0.842 . . . . 0.0 111.05 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.413 ' O ' ' N ' ' A' ' 48' ' ' GLU . 66.4 m -84.3 154.63 22.83 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.796 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -44.61 -36.33 3.01 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.792 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -80.27 -30.2 38.36 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.589 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 tp10 -81.9 -17.01 48.7 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.529 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.617 HG23 HD13 ' A' ' 41' ' ' LEU . 70.0 mt -82.06 -33.8 11.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.819 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.3 mt -61.21 -59.32 4.46 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.814 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -51.36 -31.14 21.14 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.139 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.429 ' HA ' HD12 ' A' ' 52' ' ' LEU . 9.1 tp -83.66 -16.15 46.16 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.422 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -81.13 -27.35 35.56 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.122 -1.031 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -68.04 -64.25 0.9 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.192 -1.003 . . . . 0.0 110.392 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.55 -54.01 5.2 Favored 'General case' 0 C--N 1.307 -1.274 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.36 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.419 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 10.9 ttt180 -42.5 -35.93 1.2 Allowed 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.95 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.2 tpt85 -72.55 -31.75 65.52 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.416 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 55' ' ' ARG . 17.6 m -67.5 -33.21 74.64 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.094 -1.042 . . . . 0.0 110.295 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.693 ' HB3' HG21 ' A' ' 30' ' ' VAL . 26.7 mt -68.18 -36.26 79.32 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.222 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -57.16 -16.84 8.79 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.42 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.468 ' C ' ' ND2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -87.91 -53.6 4.66 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.936 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.439 ' N ' HD22 ' A' ' 61' ' ' ASN . 0.4 OUTLIER -51.06 171.15 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.933 -179.979 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -44.03 -39.28 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 119.365 -1.398 . . . . 0.0 110.004 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.302 -1.457 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.187 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.526 HD23 ' CD2' ' A' ' 29' ' ' LEU . 6.2 tp . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 121.728 0.775 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.97 161.35 0.07 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.193 -1.003 . . . . 0.0 110.958 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.55 ' CB ' HD11 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.15 -41.5 94.65 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.918 179.879 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -59.66 -18.66 43.75 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.818 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.18 -55.1 3.66 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.266 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.526 ' CD2' HD23 ' A' ' 24' ' ' LEU . 55.0 mt -37.78 -47.91 1.05 Allowed 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.983 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.468 ' CG2' HD13 ' A' ' 59' ' ' LEU . 2.3 t -67.27 -57.25 10.49 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.974 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.184 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.62 -27.84 12.51 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 118.577 -1.249 . . . . 0.0 108.854 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.414 ' CE ' HD21 ' A' ' 24' ' ' LEU . 3.2 mtp -91.34 100.3 13.11 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.34 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.1 t -59.02 159.61 6.99 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.135 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' LEU . 41.2 t -45.87 -54.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.99 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -47.63 -41.87 23.02 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 118.643 -1.223 . . . . 0.0 109.997 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -76.82 -23.65 52.78 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.722 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 34' ' ' VAL . 14.6 tp -73.37 -46.06 51.24 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.885 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.532 HD22 ' N ' ' A' ' 38' ' ' ASN . 1.0 OUTLIER -49.9 -32.43 14.57 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.059 -1.057 . . . . 0.0 110.788 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.497 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -62.18 -18.54 61.28 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.801 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CD2' HD22 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -108.57 -21.33 12.76 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.873 -0.731 . . . . 0.0 111.152 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.654 HD23 HD12 ' A' ' 44' ' ' LEU . 31.1 mt -70.13 -23.94 63.1 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.299 -0.96 . . . . 0.0 111.695 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.503 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -62.2 6.95 0.07 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 118.613 -1.235 . . . . 0.0 110.685 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.605 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -120.53 2.62 12.36 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.654 HD12 HD23 ' A' ' 41' ' ' LEU . 24.1 mt -110.98 155.89 22.04 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 m -77.58 -172.68 2.66 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.333 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.47 ' HG3' ' N ' ' A' ' 47' ' ' GLU . 24.4 pttt -68.19 -49.6 59.79 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.849 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.47 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 13.3 tp10 -69.7 -26.46 64.36 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.745 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -76.91 -19.99 56.75 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.489 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.447 HG12 HD22 ' A' ' 41' ' ' LEU . 9.4 mt -82.25 -43.22 19.22 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 119.214 -0.995 . . . . 0.0 109.936 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 63.3 mt -62.01 -53.48 47.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 C-N-CA 119.423 -0.911 . . . . 0.0 110.28 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -49.74 -45.48 49.43 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.076 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 tp -62.49 -35.58 79.82 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.517 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -65.43 -11.3 41.41 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.248 -0.981 . . . . 0.0 111.253 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -91.0 -45.64 8.6 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.199 -1.0 . . . . 0.0 111.324 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -64.05 -56.53 14.3 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 118.836 -1.146 . . . . 0.0 110.237 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 35.6 ttt-85 -50.37 -30.74 12.94 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.988 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -77.03 -29.93 55.49 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.417 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 m -69.83 -36.24 75.44 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.867 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.55 HD11 ' CB ' ' A' ' 26' ' ' ASP . 41.7 mt -66.53 -49.07 67.71 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.079 -1.048 . . . . 0.0 110.544 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mmmt -53.58 -18.61 3.02 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.612 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -96.13 -47.49 6.04 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.278 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.444 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -56.63 179.59 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.052 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.444 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -42.59 -43.12 4.92 Favored Glycine 0 N--CA 1.493 2.467 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.661 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--N 1.303 -1.421 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.91 -179.917 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.456 HD11 ' SD ' ' A' ' 32' ' ' MET . 5.1 tp . . . . . 0 C--O 1.216 -0.684 0 CA-C-O 122.071 0.939 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.407 ' C ' ' O ' ' A' ' 24' ' ' LEU . 1.2 p -41.97 152.81 0.07 Allowed 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.727 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.609 ' CG ' HH21 ' A' ' 55' ' ' ARG . 10.1 m-20 -52.28 -38.99 59.88 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 118.783 -1.167 . . . . 0.0 110.279 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -62.69 -18.24 62.08 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 119.467 -0.893 . . . . 0.0 111.738 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -90.76 -48.71 6.87 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.876 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.545 HD22 ' HB2' ' A' ' 56' ' ' ARG . 9.7 mt -39.98 -46.99 2.18 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.565 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.492 HG23 HD13 ' A' ' 59' ' ' LEU . 4.2 t -69.33 -61.13 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.079 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.028 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.401 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -46.03 -22.73 0.23 Allowed 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 118.888 -1.125 . . . . 0.0 109.576 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.467 ' N ' ' C ' ' A' ' 30' ' ' VAL . 28.8 mtp -91.17 92.96 8.9 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.453 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 37' ' ' LEU . 1.6 t -53.01 176.25 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.889 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 t -53.69 -62.81 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.821 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.424 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 21.1 ptt180 -50.71 -33.18 21.82 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 118.942 -1.103 . . . . 0.0 110.024 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 21.8 mt-10 -78.59 -31.83 47.38 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.614 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.547 HD22 ' HD3' ' A' ' 56' ' ' ARG . 15.9 tp -73.86 -45.26 52.14 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.62 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -54.02 -32.56 54.7 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 118.997 -1.081 . . . . 0.0 110.225 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -27.32 68.28 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.662 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.33 -30.04 14.72 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.653 -0.819 . . . . 0.0 110.757 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 44' ' ' LEU . 44.3 mt -72.46 -32.98 66.7 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.2 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -52.82 88.59 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.112 -1.035 . . . . 0.0 110.179 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.557 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 142.03 -15.08 2.59 Favored Glycine 0 C--N 1.297 -1.606 0 N-CA-C 109.309 -1.517 . . . . 0.0 109.309 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.89 HD12 HD23 ' A' ' 41' ' ' LEU . 17.6 mt -84.95 169.4 14.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.679 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.75 154.05 19.82 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.7 tptt -45.23 -58.34 3.33 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.082 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 48' ' ' GLU . 8.4 pt-20 -57.29 -26.45 60.89 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.454 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 15.6 tp10 -83.87 -25.7 30.04 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.089 -1.044 . . . . 0.0 109.878 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.534 HG13 HD22 ' A' ' 41' ' ' LEU . 1.1 mp -71.38 -37.57 65.59 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.2 mt -60.13 -60.14 3.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.972 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -48.08 -36.96 14.06 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.47 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.458 ' CD1' ' CD1' ' A' ' 44' ' ' LEU . 16.3 mt -85.12 -19.62 31.56 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.132 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -83.99 -3.47 58.02 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.279 -0.969 . . . . 0.0 110.712 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -104.35 -62.35 1.33 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.097 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.609 HH21 ' CG ' ' A' ' 26' ' ' ASP . 3.9 ttt180 -44.8 -54.2 6.61 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.843 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.547 ' HD3' HD22 ' A' ' 37' ' ' LEU . 53.2 ttp85 -46.92 -35.11 6.11 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.076 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.3 ttt-85 -76.11 -34.15 59.48 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.274 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -62.78 -37.42 86.58 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.785 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.492 HD13 HG23 ' A' ' 30' ' ' VAL . 27.9 mt -66.03 -46.3 78.36 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.29 -0.964 . . . . 0.0 110.604 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -55.0 -17.47 3.81 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.242 -0.983 . . . . 0.0 110.566 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -95.26 -40.38 9.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.958 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.585 ' CG ' ' H ' ' A' ' 63' ' ' GLY . 40.0 ttp85 -64.14 178.74 0.64 Allowed 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.989 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.585 ' H ' ' CG ' ' A' ' 62' ' ' ARG . . . -44.09 -39.1 5.07 Favored Glycine 0 N--CA 1.492 2.394 0 C-N-CA 119.444 -1.36 . . . . 0.0 110.114 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--N 1.304 -1.395 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.508 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.403 0.62 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 p -69.54 156.29 39.13 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.051 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.31 -35.6 72.11 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.489 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 3.9 mp0 -63.6 -27.04 68.96 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.282 -0.967 . . . . 0.0 110.506 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' VAL . 3.0 mt-10 -78.13 -49.45 13.86 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.059 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.467 ' HA ' HD23 ' A' ' 29' ' ' LEU . 12.1 mt -37.41 -24.85 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.943 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -99.08 -59.06 3.47 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.345 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.56 -45.0 9.18 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.761 -1.176 . . . . 0.0 109.119 179.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.435 ' O ' ' CG ' ' A' ' 32' ' ' MET . 2.7 ptt? -92.31 120.64 33.04 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.111 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.7 p -77.31 -165.55 0.6 Allowed 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.636 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.4 t -56.16 -49.83 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.789 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.419 ' H ' ' HG2' ' A' ' 35' ' ' ARG . 21.5 mmm180 -44.37 -51.49 8.51 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.248 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 36' ' ' GLU . 2.6 mp0 -71.97 -30.12 64.94 Favored 'General case' 0 C--N 1.295 -1.799 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.452 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.402 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 2.6 tt -65.82 -45.35 82.62 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.959 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -58.71 -14.94 9.84 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.056 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -15.51 44.26 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.788 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.567 ' NE2' HD13 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -99.25 -46.3 5.58 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.525 -179.835 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.711 HD12 ' N ' ' A' ' 42' ' ' ARG . 0.3 OUTLIER -66.55 5.63 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.496 -179.861 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.711 ' N ' HD12 ' A' ' 41' ' ' LEU . 9.8 mtp85 -44.9 99.24 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.733 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 107.42 8.62 30.57 Favored Glycine 0 N--CA 1.483 1.813 0 C-N-CA 119.926 -1.13 . . . . 0.0 111.832 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.576 HD12 ' CB ' ' A' ' 41' ' ' LEU . 19.6 mt -84.21 151.4 24.86 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 117.437 -1.705 . . . . 0.0 110.823 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.449 ' OG ' ' OE2' ' A' ' 47' ' ' GLU . 33.7 t -78.54 171.05 15.68 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.631 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -59.87 -40.98 90.51 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.785 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.725 ' CD ' ' H ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -79.49 -16.98 55.12 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.707 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.565 ' HG2' HD22 ' A' ' 44' ' ' LEU . 18.2 tt0 -89.73 -20.34 23.69 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.298 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 48.6 mt -82.89 -35.36 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.593 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.273 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.239 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.76 -50.47 63.43 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.09 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.567 HD13 ' NE2' ' A' ' 40' ' ' HIS . 27.8 mt -67.61 -20.07 65.31 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.917 -1.113 . . . . 0.0 110.387 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.26 -19.94 38.58 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.658 -0.817 . . . . 0.0 110.436 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -76.62 -59.1 2.91 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.652 -0.819 . . . . 0.0 111.034 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.9 mmt-85 -55.57 -46.86 77.13 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.356 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.455 ' NH2' ' HE3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -51.28 -35.66 38.53 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.804 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.66 -35.77 70.44 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.717 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 17.1 m -58.88 -44.31 91.12 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.069 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.404 HD13 ' CG2' ' A' ' 30' ' ' VAL . 44.2 mt -65.95 -50.46 64.29 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.8 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.455 ' HE3' ' NH2' ' A' ' 56' ' ' ARG . 0.3 OUTLIER -56.63 -12.15 1.68 Allowed 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.735 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -96.53 -52.32 3.99 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.545 -0.862 . . . . 0.0 111.212 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.421 ' HB3' HH21 ' A' ' 62' ' ' ARG . 26.4 mtp85 -57.43 -171.77 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.548 -0.861 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.6 -46.14 5.71 Favored Glycine 0 N--CA 1.492 2.37 0 C-N-CA 119.592 -1.289 . . . . 0.0 110.43 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.394 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.379 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.463 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 121.384 0.612 . . . . 0.0 110.184 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -170.51 0.54 Allowed 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.711 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.525 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -80.5 -53.84 6.21 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.234 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 64' ' ' TYR . 14.2 mt-10 -58.59 -13.75 6.51 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 118.917 -1.113 . . . . 0.0 109.446 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.411 ' C ' ' N ' ' A' ' 30' ' ' VAL . 28.4 mm-40 -79.79 -49.03 12.6 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.523 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 28' ' ' GLU . 46.5 mt -41.61 -30.41 0.22 Allowed 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.117 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.507 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -83.33 -61.86 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.338 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.68 -29.92 2.11 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.615 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 3.1 mtp -90.7 95.57 10.21 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.615 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 33.2 t -44.04 146.83 0.57 Allowed 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.712 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.465 ' H ' HG23 ' A' ' 34' ' ' VAL . 2.0 t -41.37 -47.99 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.936 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -53.08 -41.82 65.27 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.902 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.524 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 1.3 mp0 -73.73 -22.01 60.03 Favored 'General case' 0 C--N 1.309 -1.188 0 C-N-CA 119.141 -1.024 . . . . 0.0 109.584 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.438 ' C ' ' N ' ' A' ' 39' ' ' GLN . 13.4 tp -79.31 -51.28 9.65 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.126 -1.03 . . . . 0.0 108.908 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -53.26 -19.26 3.01 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.025 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.438 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -68.91 -42.76 76.42 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.52 179.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.455 ' CG ' ' N ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -75.3 -47.04 29.69 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.069 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 1.009 HD23 HD12 ' A' ' 44' ' ' LEU . 27.9 mt -42.66 -29.68 0.32 Allowed 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.087 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -45.96 95.62 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.577 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 133.46 -13.94 4.82 Favored Glycine 0 N--CA 1.484 1.838 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 1.009 HD12 HD23 ' A' ' 41' ' ' LEU . 16.4 mt -91.44 127.77 37.02 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.069 -1.052 . . . . 0.0 110.818 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.1 m -47.87 165.01 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.524 -0.871 . . . . 0.0 110.836 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.561 ' O ' HD13 ' A' ' 50' ' ' ILE . 7.3 pttm -61.26 -20.52 62.95 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.001 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -85.79 -32.76 21.63 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.859 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.06 -13.35 59.82 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.079 -1.049 . . . . 0.0 109.984 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mt -81.78 -36.6 14.47 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.023 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 46' ' ' LYS . 1.5 mp -69.78 -33.75 57.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.69 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -64.62 -27.47 68.96 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 mp -93.53 -27.3 16.72 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.257 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -71.91 5.66 2.5 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.302 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -102.56 -64.51 1.06 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 119.831 -0.747 . . . . 0.0 111.204 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 58' ' ' THR . 38.2 mtt85 -50.86 -50.03 57.72 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.058 -1.057 . . . . 0.0 110.994 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.423 HH21 ' CG2' ' A' ' 34' ' ' VAL . 0.8 OUTLIER -48.13 -33.24 7.99 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 118.971 -1.092 . . . . 0.0 110.542 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -79.3 -22.55 44.47 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.867 -1.133 . . . . 0.0 110.334 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.436 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.8 m -79.59 -42.28 25.33 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.258 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.507 HD13 ' CG2' ' A' ' 30' ' ' VAL . 27.0 mt -58.84 -54.6 45.24 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.555 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -45.35 -22.18 0.12 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.264 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.412 ' N ' ' C ' ' A' ' 59' ' ' LEU . 27.2 t-20 -100.31 -45.9 5.44 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 119.637 -0.825 . . . . 0.0 111.906 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.505 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 11.0 ttt180 -53.37 176.53 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.23 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.505 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.8 -33.3 1.07 Allowed Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.685 -1.245 . . . . 0.0 110.318 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 27' ' ' GLU . 3.0 t80 . . . . . 0 C--N 1.306 -1.298 0 C-N-CA 119.316 -0.953 . . . . 0.0 110.319 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 121.417 0.627 . . . . 0.0 110.112 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.1 p -59.27 178.18 0.15 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.244 -0.982 . . . . 0.0 110.909 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -69.37 -33.72 73.47 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.09 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.613 ' N ' ' CD ' ' A' ' 27' ' ' GLU . 4.0 mp0 -63.5 -53.84 45.71 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.8 -1.16 . . . . 0.0 109.318 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.471 ' HB3' ' SD ' ' A' ' 32' ' ' MET . 21.9 mt-10 -45.51 -48.68 14.13 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.368 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.509 HD22 ' HB2' ' A' ' 56' ' ' ARG . 6.5 mt -44.91 -35.35 2.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.943 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.556 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.3 t -99.87 -53.68 7.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.112 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.77 -26.16 0.23 Allowed 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.661 -1.216 . . . . 0.0 109.396 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.471 ' SD ' ' HB3' ' A' ' 28' ' ' GLU . 28.5 mtp -90.39 104.35 16.94 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.629 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 13.8 t -47.51 -96.16 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.24 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.419 ' N ' ' OG ' ' A' ' 33' ' ' SER . 47.8 t -138.04 -30.96 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.033 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -71.82 -52.77 15.84 Favored 'General case' 0 C--N 1.3 -1.578 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.403 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -66.2 -30.56 71.04 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.169 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD11 ' CD ' ' A' ' 56' ' ' ARG . 1.3 tt -73.99 -51.44 15.92 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -54.72 -16.8 2.78 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 0.8 OUTLIER -77.03 -39.22 50.97 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.337 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -38.97 34.94 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.92 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.593 HD23 HD12 ' A' ' 44' ' ' LEU . 16.2 mt -48.14 -30.4 4.53 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.024 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.523 ' HE ' ' HA ' ' A' ' 42' ' ' ARG . 15.0 mmm-85 -58.61 86.13 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.823 -1.151 . . . . 0.0 110.001 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 152.06 -13.11 0.73 Allowed Glycine 0 C--N 1.292 -1.893 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.593 HD12 HD23 ' A' ' 41' ' ' LEU . 13.6 mt -94.89 123.14 38.19 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.575 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 48' ' ' GLU . 94.0 p -66.86 155.61 37.91 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.338 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -43.82 -29.27 0.52 Allowed 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.67 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -83.56 -31.64 26.26 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.623 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 45' ' ' SER . 0.0 OUTLIER -81.71 -16.86 49.83 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.503 HG12 HD22 ' A' ' 41' ' ' LEU . 21.9 mt -81.63 -35.97 14.13 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.044 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -72.85 -50.06 35.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.657 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -65.89 -15.51 63.01 Favored 'General case' 0 C--N 1.296 -1.72 0 C-N-CA 119.291 -0.964 . . . . 0.0 110.297 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.848 HD13 ' C ' ' A' ' 52' ' ' LEU . 3.0 tm? -101.02 -51.97 3.4 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.188 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.445 ' N ' HD13 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -56.5 -6.46 0.3 Allowed 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.62 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.5 tt0 -72.02 -71.65 0.27 Allowed 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.46 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.3 -51.49 6.25 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.022 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.509 ' HB2' HD22 ' A' ' 29' ' ' LEU . 64.7 ttp85 -42.58 -36.82 1.48 Allowed 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.187 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.1 ttm-85 -72.52 -31.4 65.3 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.384 -0.926 . . . . 0.0 110.544 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.524 ' N ' ' O ' ' A' ' 55' ' ' ARG . 21.9 m -67.98 -33.26 74.31 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.767 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 30' ' ' VAL . 45.6 mt -66.03 -49.75 66.61 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.122 -1.031 . . . . 0.0 110.416 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.3 mmtt -52.48 -15.67 0.72 Allowed 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -93.33 -50.48 5.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.563 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -51.17 171.72 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.153 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.66 -29.88 0.83 Allowed Glycine 0 N--CA 1.492 2.419 0 C-N-CA 119.677 -1.249 . . . . 0.0 110.662 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--N 1.302 -1.475 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.736 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.519 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.3 0.572 . . . . 0.0 110.575 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.467 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -83.64 176.06 9.27 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.287 -0.965 . . . . 0.0 110.458 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.33 -47.22 79.21 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.374 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.93 -43.02 97.13 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 118.859 -1.136 . . . . 0.0 109.355 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HB2' ' N ' ' A' ' 25' ' ' THR . 12.7 mm-40 -55.11 -44.74 75.23 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.649 -0.821 . . . . 0.0 111.367 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 14.2 mt -47.53 -34.02 7.09 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.422 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.707 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.7 t -94.13 -56.35 5.28 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 119.555 -0.858 . . . . 0.0 111.828 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.96 -29.66 0.87 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.002 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.481 ' SD ' ' HA ' ' A' ' 29' ' ' LEU . 12.8 ptm -92.42 120.74 33.22 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.266 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 78.1 p -63.87 -145.16 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.995 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.8 t -92.69 -42.69 13.44 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.966 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -51.6 -45.23 63.11 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.949 -1.101 . . . . 0.0 110.117 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -73.23 -28.18 62.02 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.947 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.518 HD21 HH22 ' A' ' 56' ' ' ARG . 9.2 tp -72.68 -43.7 62.76 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.628 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 -56.27 -18.04 9.36 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.01 -1.076 . . . . 0.0 109.958 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -26.72 43.36 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.388 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.4 ' O ' ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -96.7 -36.97 10.5 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.692 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 43' ' ' GLY . 12.1 mt -42.28 -36.82 1.33 Allowed 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.016 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -59.46 84.37 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 119.054 -1.058 . . . . 0.0 110.053 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 156.76 -14.48 0.34 Allowed Glycine 0 C--N 1.293 -1.812 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.602 ' CD1' HD22 ' A' ' 52' ' ' LEU . 5.1 mt -96.94 129.23 44.42 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.64 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 48' ' ' GLU . 2.4 t -73.35 157.72 36.42 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.233 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -44.33 -40.0 5.0 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.228 -0.989 . . . . 0.0 110.767 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.62 -14.06 57.18 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.634 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.513 ' N ' ' O ' ' A' ' 45' ' ' SER . 25.9 tp10 -90.46 -25.25 20.42 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.462 -0.895 . . . . 0.0 109.832 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 32.1 mt -78.42 -22.36 13.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.091 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.463 HG22 ' N ' ' A' ' 51' ' ' GLN . 9.9 mt -71.74 -62.21 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.318 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.463 ' N ' HG22 ' A' ' 50' ' ' ILE . 2.8 pt20 -50.64 -31.85 17.33 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.602 HD22 ' CD1' ' A' ' 44' ' ' LEU . 2.1 tp -75.15 -39.4 60.43 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.613 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.453 ' HD3' ' NH2' ' A' ' 56' ' ' ARG . 37.0 mmtt -62.08 -3.55 1.3 Allowed 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.482 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.433 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.7 tt0 -88.09 -75.09 0.43 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.957 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.474 ' HE ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -49.14 -45.82 44.24 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.466 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.518 HH22 HD21 ' A' ' 37' ' ' LEU . 5.1 tmm_? -53.41 -38.87 63.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.951 -1.1 . . . . 0.0 109.59 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -74.64 -34.9 62.85 Favored 'General case' 0 C--N 1.304 -1.376 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.286 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -61.18 -34.51 75.18 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 119.026 -1.07 . . . . 0.0 110.155 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.707 ' HB3' HG21 ' A' ' 30' ' ' VAL . 37.8 mt -69.05 -34.27 74.9 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.354 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -70.73 -9.7 57.82 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.581 -0.848 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.73 -56.99 2.34 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.665 -0.814 . . . . 0.0 111.674 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 ttt-85 -52.72 176.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -40.89 -30.96 0.4 Allowed Glycine 0 N--CA 1.494 2.541 0 C-N-CA 119.752 -1.213 . . . . 0.0 110.408 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 C--N 1.303 -1.428 0 C-N-CA 119.339 -0.944 . . . . 0.0 110.358 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.508 ' HG ' ' NE2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 121.091 0.472 . . . . 0.0 110.407 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.419 ' H ' HG23 ' A' ' 25' ' ' THR . 44.7 p -55.81 179.87 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.881 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -71.53 -32.32 68.02 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 118.984 -1.087 . . . . 0.0 110.311 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.431 ' H ' ' HG3' ' A' ' 27' ' ' GLU . 19.0 mt-10 -62.43 -20.73 64.79 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -87.07 -41.71 13.62 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.119 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 56' ' ' ARG . 6.5 mt -41.4 -34.84 0.58 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.28 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.547 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -85.4 -61.7 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.711 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.923 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -26.93 0.82 Allowed 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.001 -1.08 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.5 mtp -90.3 92.1 8.78 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.979 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 34' ' ' VAL . 74.6 p -46.99 162.78 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.404 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 34' ' ' VAL . 21.5 t -39.9 -57.61 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.152 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.64 30.23 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.432 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -60.19 -39.36 86.26 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.172 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 tp -68.4 -49.43 60.09 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.521 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.24 -14.22 2.66 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.545 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -84.17 -33.52 24.19 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.394 -0.923 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.531 ' O ' ' N ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -85.76 -36.59 20.04 Favored 'General case' 0 C--N 1.305 -1.35 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.873 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.708 HD23 HD12 ' A' ' 44' ' ' LEU . 32.8 mt -47.13 -12.14 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.209 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 40' ' ' HIS . 10.7 mmm180 -70.86 31.81 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.512 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.607 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -152.49 4.31 0.4 Allowed Glycine 0 C--N 1.294 -1.791 0 N-CA-C 109.261 -1.535 . . . . 0.0 109.261 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.708 HD12 HD23 ' A' ' 41' ' ' LEU . 15.2 mt -106.04 165.64 11.07 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.46 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.448 ' O ' ' N ' ' A' ' 49' ' ' ILE . 1.2 m -96.36 156.32 16.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.749 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -42.91 -46.04 5.21 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.124 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -71.13 -36.58 72.17 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -79.91 -11.34 59.81 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.093 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.448 ' N ' ' O ' ' A' ' 45' ' ' SER . 45.6 mt -90.49 -40.95 13.18 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 C-N-CA 119.693 -0.803 . . . . 0.0 110.675 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -58.13 -56.93 12.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.124 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -51.05 -29.06 11.75 Favored 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.776 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.416 HD22 ' CD1' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -78.63 -35.25 45.74 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.937 -1.105 . . . . 0.0 111.343 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 21.4 mttt -59.3 -21.67 60.05 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.406 -0.918 . . . . 0.0 111.526 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.421 ' O ' ' N ' ' A' ' 57' ' ' ARG . 8.7 tt0 -98.88 -69.8 0.75 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.524 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.2 OUTLIER -40.33 -50.9 2.81 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.214 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.535 ' HB2' HD22 ' A' ' 29' ' ' LEU . 1.0 OUTLIER -46.95 -36.03 7.2 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 118.79 -1.164 . . . . 0.0 109.927 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.447 ' HD2' ' NH1' ' A' ' 56' ' ' ARG . 5.4 tpt85 -77.01 -18.94 57.85 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.474 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.522 ' N ' ' O ' ' A' ' 55' ' ' ARG . 3.3 m -82.64 -34.62 27.46 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.02 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.547 HD13 ' CG2' ' A' ' 30' ' ' VAL . 15.3 mt -51.95 -51.81 54.54 Favored 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.895 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -49.14 -17.97 0.28 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.992 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 59' ' ' LEU . 66.1 m-20 -106.14 -35.24 7.28 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.007 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.498 ' NE ' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -62.45 -169.64 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.505 -0.878 . . . . 0.0 110.948 -179.969 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.498 ' H ' ' NE ' ' A' ' 62' ' ' ARG . . . -43.86 -56.36 5.14 Favored Glycine 0 N--CA 1.491 2.326 0 C-N-CA 119.504 -1.331 . . . . 0.0 110.696 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.486 1.347 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.192 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.492 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.391 0.615 . . . . 0.0 109.98 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.7 p -63.64 -178.4 0.29 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.735 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -75.26 -36.13 61.3 Favored 'General case' 0 C--N 1.3 -1.587 0 C-N-CA 119.306 -0.957 . . . . 0.0 110.286 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.625 ' OE1' ' CE1' ' A' ' 64' ' ' TYR . 18.2 mm-40 -68.91 -6.87 29.99 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.935 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -90.34 -49.98 6.22 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.061 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.444 HD23 HD13 ' A' ' 37' ' ' LEU . 62.5 mt -43.05 -37.73 2.05 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.451 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.51 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.7 t -76.96 -55.33 11.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.177 -1.009 . . . . 0.0 110.525 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -48.52 -29.35 4.1 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.467 -1.293 . . . . 0.0 108.648 179.805 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 58.3 mtp -90.84 104.22 16.83 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.159 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m -46.65 -92.78 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.827 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.89 -30.4 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 C-N-CA 119.586 -0.846 . . . . 0.0 109.846 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -74.8 -36.68 62.48 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.308 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.92 -26.43 48.99 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.473 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.444 HD13 HD23 ' A' ' 29' ' ' LEU . 23.1 tp -79.2 -46.23 18.29 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.525 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -68.05 -8.54 38.66 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.664 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.532 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 1.8 mm-40 -80.83 -24.9 38.12 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.033 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.47 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -104.87 -30.11 10.07 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.369 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.624 HD23 HD12 ' A' ' 44' ' ' LEU . 17.2 mt -57.93 -37.33 73.88 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.585 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -55.51 -0.27 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.813 -1.155 . . . . 0.0 110.936 -179.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.613 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -100.37 -9.87 46.29 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.624 HD12 HD23 ' A' ' 41' ' ' LEU . 67.0 mt -98.5 178.11 5.13 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.647 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.612 ' OG ' ' N ' ' A' ' 46' ' ' LYS . 28.7 t -79.51 -170.08 2.18 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.319 -0.952 . . . . 0.0 110.249 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.612 ' N ' ' OG ' ' A' ' 45' ' ' SER . 8.7 mtpp -79.78 -38.62 32.72 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.768 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.15 -25.17 51.69 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.462 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.437 ' O ' HD23 ' A' ' 52' ' ' LEU . 46.3 mm-40 -78.41 -17.2 56.73 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.369 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.413 HD12 ' O ' ' A' ' 45' ' ' SER . 35.4 mt -86.12 -27.67 6.15 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.345 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.896 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.5 HG22 ' N ' ' A' ' 51' ' ' GLN . 12.4 mt -66.16 -63.86 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.5 ' N ' HG22 ' A' ' 50' ' ' ILE . 18.2 mt-30 -57.43 -27.92 62.83 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.54 -0.864 . . . . 0.0 111.494 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 48' ' ' GLU . 3.4 mm? -76.89 -28.65 55.43 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.925 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -37.68 68.59 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.587 -0.845 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -79.04 -38.4 36.64 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.196 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 58' ' ' THR . 7.1 ttt180 -56.17 -55.68 30.13 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.484 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.491 ' C ' ' CD ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -46.25 -41.34 12.82 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 118.946 -1.102 . . . . 0.0 109.526 179.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -66.63 -34.27 77.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.555 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.411 ' N ' ' O ' ' A' ' 55' ' ' ARG . 4.1 m -65.96 -38.33 88.29 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.544 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.51 HD13 ' CG2' ' A' ' 30' ' ' VAL . 17.2 mt -58.14 -48.93 78.74 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.067 -1.053 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.83 -23.61 0.29 Allowed 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 119.254 -0.978 . . . . 0.0 110.56 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 59' ' ' LEU . 2.1 t30 -98.87 -37.33 9.47 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 119.594 -0.842 . . . . 0.0 111.167 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.7 ttt-85 -59.51 178.61 0.14 Allowed 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.976 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.89 -45.46 5.9 Favored Glycine 0 N--CA 1.493 2.439 0 C-N-CA 119.624 -1.274 . . . . 0.0 110.258 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.625 ' CE1' ' OE1' ' A' ' 27' ' ' GLU . 5.1 t80 . . . . . 0 C--N 1.302 -1.492 0 C-N-CA 119.581 -0.848 . . . . 0.0 110.451 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.525 HD11 ' SD ' ' A' ' 32' ' ' MET . 11.0 tp . . . . . 0 C--O 1.215 -0.711 0 CA-C-O 121.356 0.598 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.2 p -62.94 177.99 0.51 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 118.557 -1.257 . . . . 0.0 110.066 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.22 -28.06 59.8 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.359 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.63 -18.09 63.57 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.94 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -90.2 -42.55 10.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.394 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.483 ' HA ' HD23 ' A' ' 29' ' ' LEU . 14.4 mt -42.62 -35.75 1.19 Allowed 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.065 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 30' ' ' VAL . 1.6 t -82.06 -61.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.464 -0.894 . . . . 0.0 110.873 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.33 -24.3 0.47 Allowed 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 118.863 -1.135 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.525 ' SD ' HD11 ' A' ' 24' ' ' LEU . 15.0 mtp -90.31 91.41 8.48 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.827 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 40.4 t -47.64 164.62 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.95 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.3 t -41.63 -56.57 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.095 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' HE ' ' HB2' ' A' ' 35' ' ' ARG . 11.0 tpp180 -52.63 -46.79 67.24 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.183 -1.007 . . . . 0.0 110.474 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.97 -43.37 98.97 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.146 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.5 tp -66.78 -45.7 77.62 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.869 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -57.86 -22.84 50.1 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.193 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.3 -24.93 59.3 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.756 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.477 ' CD2' HD22 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -98.07 -19.43 17.97 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.589 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.652 ' C ' ' H ' ' A' ' 43' ' ' GLY . 30.9 mt -76.4 -23.25 54.03 Favored 'General case' 0 C--N 1.304 -1.412 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.702 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 -69.28 27.96 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.701 -1.2 . . . . 0.0 110.66 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.652 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -139.44 -3.08 1.66 Allowed Glycine 0 N--CA 1.479 1.555 0 N-CA-C 109.028 -1.629 . . . . 0.0 109.028 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.45 ' CD1' HD12 ' A' ' 52' ' ' LEU . 22.4 mt -103.03 178.75 4.47 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.991 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.4 t -90.88 153.4 20.23 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.658 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -48.73 -42.48 35.4 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.043 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.505 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 1.8 mp0 -75.85 -23.93 55.73 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.231 -0.988 . . . . 0.0 110.773 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.438 ' HG3' HD13 ' A' ' 44' ' ' LEU . 25.1 tp10 -82.12 -19.37 40.22 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.017 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.486 HG22 HD12 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -76.06 -32.16 22.71 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.33 0 C-N-CA 119.536 -0.865 . . . . 0.0 109.696 179.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.486 HD12 HG22 ' A' ' 49' ' ' ILE . 1.5 mp -70.3 -32.61 51.12 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 C-N-CA 119.659 -0.816 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -65.99 -39.04 89.98 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.043 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 44' ' ' LEU . 93.1 mt -86.33 -34.12 20.38 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.418 -0.913 . . . . 0.0 111.253 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -62.7 -12.99 27.15 Favored 'General case' 0 C--N 1.304 -1.389 0 C-N-CA 119.237 -0.985 . . . . 0.0 110.791 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.04 -68.64 0.79 Allowed 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.5 mtp180 -48.47 -47.96 38.12 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.03 -1.068 . . . . 0.0 110.386 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.3 tmm_? -47.75 -42.91 26.57 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.073 -1.051 . . . . 0.0 109.959 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -68.9 -29.53 67.82 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.284 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -66.05 -37.69 86.48 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.3 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.439 HD13 ' CG2' ' A' ' 30' ' ' VAL . 41.4 mt -66.27 -53.21 39.52 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.178 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -57.6 -14.01 4.7 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.446 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -90.13 -62.02 1.56 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.423 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 63' ' ' GLY . 10.1 ptp180 -52.4 176.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.729 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -37.8 -42.7 1.11 Allowed Glycine 0 N--CA 1.498 2.793 0 C-N-CA 120.182 -1.009 . . . . 0.0 111.009 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.0 t80 . . . . . 0 C--N 1.304 -1.41 0 C-N-CA 119.258 -0.977 . . . . 0.0 110.49 179.974 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 24' ' ' LEU . 13.4 tp . . . . . 0 CA--C 1.491 -1.299 0 CA-C-O 121.69 0.757 . . . . 0.0 112.109 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -52.21 171.31 0.05 Allowed 'General case' 0 C--N 1.283 -2.291 0 C-N-CA 118.714 -1.194 . . . . 0.0 110.637 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.18 -28.37 64.19 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.338 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -71.24 -11.55 60.98 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.73 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -89.37 -45.21 9.64 Favored 'General case' 0 C--N 1.308 -1.21 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.21 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.1 mt -41.27 -31.55 0.23 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.615 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.437 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.4 t -85.75 -61.27 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.169 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -27.75 1.16 Allowed 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 118.934 -1.106 . . . . 0.0 110.247 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.9 mtp -90.24 91.9 8.7 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.0 t -51.04 171.2 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.829 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 77.3 t -46.09 -64.41 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 119.434 -0.907 . . . . 0.0 110.98 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.413 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 27.2 ptt-85 -47.38 -42.16 21.26 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.933 -1.107 . . . . 0.0 110.207 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 35' ' ' ARG . 9.3 tt0 -68.94 -40.01 79.21 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.875 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.465 HD22 ' CD ' ' A' ' 56' ' ' ARG . 15.1 tp -67.52 -43.1 81.64 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.446 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -49.49 -34.68 17.64 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.015 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.26 -41.17 92.67 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.27 -0.972 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.03 -38.02 57.7 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.357 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.916 HD23 HD12 ' A' ' 44' ' ' LEU . 41.6 mt -62.8 -19.31 63.93 Favored 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.643 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.85 77.89 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.149 -1.02 . . . . 0.0 110.124 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 153.84 -10.11 0.48 Allowed Glycine 0 C--N 1.295 -1.708 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.916 HD12 HD23 ' A' ' 41' ' ' LEU . 15.2 mt -92.71 151.25 20.17 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.692 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -75.37 152.3 38.09 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.779 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.506 ' HA ' HD12 ' A' ' 49' ' ' ILE . 14.6 ptpt -45.17 -41.88 8.58 Favored 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.909 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.449 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 11.5 mt-10 -75.9 -27.68 57.79 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.572 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -80.19 -19.09 47.88 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.092 -1.043 . . . . 0.0 109.91 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.537 HG23 HD13 ' A' ' 41' ' ' LEU . 8.6 mt -78.99 -33.17 15.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 C-N-CA 119.416 -0.914 . . . . 0.0 109.608 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.453 HG22 ' N ' ' A' ' 51' ' ' GLN . 12.4 mt -62.35 -62.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.419 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.453 ' N ' HG22 ' A' ' 50' ' ' ILE . 71.0 mt-30 -48.03 -30.32 4.28 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.63 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.499 ' HA ' HD22 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -68.36 -34.04 75.37 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.471 179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HD3' ' HE ' ' A' ' 56' ' ' ARG . 24.6 mmtp -77.95 -5.2 50.43 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.728 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.456 ' O ' ' N ' ' A' ' 57' ' ' ARG . 7.2 tt0 -76.03 -85.18 0.05 Allowed 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.348 -0.941 . . . . 0.0 111.031 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.521 ' H ' ' HD2' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -45.35 -37.77 5.23 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 119.062 -1.055 . . . . 0.0 110.497 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.538 ' HE ' ' HD3' ' A' ' 53' ' ' LYS . 42.5 ttp85 -57.87 -31.37 66.63 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.113 -1.035 . . . . 0.0 109.719 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' GLN . 22.1 ttp180 -75.91 -30.75 58.88 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.265 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -66.85 -37.73 85.02 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.527 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.437 HD13 ' CG2' ' A' ' 30' ' ' VAL . 39.6 mt -67.55 -51.87 45.56 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.578 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.406 ' HZ3' ' HB3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.31 -14.85 5.0 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.221 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -88.41 -63.62 1.27 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.426 -0.91 . . . . 0.0 112.351 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 64' ' ' TYR . 17.7 ptm180 -48.81 169.5 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.508 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -38.16 -31.24 0.1 OUTLIER Glycine 0 N--CA 1.497 2.75 0 C-N-CA 120.035 -1.079 . . . . 0.0 110.542 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.445 ' N ' ' O ' ' A' ' 62' ' ' ARG . 3.9 t80 . . . . . 0 C--N 1.302 -1.464 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.067 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.427 ' HA ' HD12 ' A' ' 24' ' ' LEU . 1.1 tp . . . . . 0 C--O 1.217 -0.658 0 CA-C-O 121.919 0.866 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.496 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -70.95 174.96 5.52 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.104 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -52.09 -50.33 61.82 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.161 -1.015 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 1.7 mp0 -65.69 -29.31 69.84 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.283 -0.967 . . . . 0.0 111.1 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.496 ' HB2' ' N ' ' A' ' 25' ' ' THR . 8.8 mt-10 -72.42 -35.85 68.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.203 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' A' ' 29' ' ' LEU . 49.0 mt -59.76 -44.58 93.79 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.422 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.477 ' C ' ' N ' ' A' ' 32' ' ' MET . 3.0 t -71.44 -49.66 45.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.83 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.285 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.46 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -43.47 -28.57 0.37 Allowed 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.076 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.477 ' N ' ' C ' ' A' ' 30' ' ' VAL . 30.4 mtp -92.4 113.13 25.32 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.577 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.7 t -49.23 -95.52 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.744 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.426 HG12 ' ND2' ' A' ' 38' ' ' ASN . 6.6 t -147.06 -27.49 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.834 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.4 ' HG2' ' H ' ' A' ' 35' ' ' ARG . 9.2 ptt-85 -74.03 -40.27 62.98 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.422 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -71.98 -31.29 66.11 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.279 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 20.4 tp -72.53 -51.64 19.07 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.466 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.426 ' ND2' HG12 ' A' ' 34' ' ' VAL . 98.4 m-20 -61.03 -14.44 23.34 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.68 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.58 -39.1 53.67 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.861 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.87 -26.46 22.76 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.793 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.649 HD23 HD12 ' A' ' 44' ' ' LEU . 15.8 mt -58.16 -32.88 68.62 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.334 -0.946 . . . . 0.0 111.059 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -64.2 76.68 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 118.841 -1.143 . . . . 0.0 110.053 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.532 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 167.07 -13.89 0.07 OUTLIER Glycine 0 C--N 1.294 -1.775 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.649 HD12 HD23 ' A' ' 41' ' ' LEU . 20.3 mt -87.86 170.92 10.76 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.872 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.505 ' H ' ' HB3' ' A' ' 48' ' ' GLU . 15.7 m -94.81 165.67 12.36 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.754 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -50.2 -56.83 9.44 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.22 -23.4 66.42 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 119.4 -0.92 . . . . 0.0 111.24 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.505 ' HB3' ' H ' ' A' ' 45' ' ' SER . 42.0 tt0 -84.96 -15.57 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.157 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.5 mt -89.94 -42.23 14.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.586 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mt -59.83 -49.26 84.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.012 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -54.4 -39.14 66.98 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.125 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.421 HD22 ' CD1' ' A' ' 44' ' ' LEU . 5.1 mp -73.52 -33.92 65.0 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.213 -0.995 . . . . 0.0 111.042 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.1 mttt -66.84 -5.4 12.18 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.43 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 55' ' ' ARG . 9.0 tp60 -96.89 -77.07 0.5 Allowed 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.767 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' N ' ' A' ' 58' ' ' THR . 1.2 mmp_? -42.4 -58.09 2.35 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.166 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.2 tmm_? -47.48 -38.3 13.47 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 118.782 -1.167 . . . . 0.0 109.888 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -76.7 -25.06 53.19 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.89 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' ARG . 37.0 m -77.38 -38.09 50.69 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.873 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.468 ' O ' ' N ' ' A' ' 61' ' ' ASN . 29.2 mt -59.17 -60.8 3.28 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.607 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.421 ' HG3' HG13 ' A' ' 30' ' ' VAL . 15.7 mtpp -43.38 -22.16 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.609 -0.837 . . . . 0.0 111.188 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 59' ' ' LEU . 25.0 t30 -93.56 -42.89 8.97 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.157 -1.017 . . . . 0.0 111.437 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -62.83 -160.9 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.308 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.22 96.36 Favored Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.623 -1.275 . . . . 0.0 110.903 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--N 1.305 -1.337 0 C-N-CA 119.133 -1.027 . . . . 0.0 110.859 -179.966 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.498 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.445 ' OG1' ' OE1' ' A' ' 28' ' ' GLU . 2.8 p -57.73 -175.03 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 118.796 -1.162 . . . . 0.0 110.771 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -69.9 -38.52 76.34 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.86 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 27' ' ' GLU . 6.0 pt-20 -61.35 -41.48 97.13 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.904 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.445 ' OE1' ' OG1' ' A' ' 25' ' ' THR . 0.3 OUTLIER -52.24 -49.85 63.19 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.578 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.474 HD21 HD11 ' A' ' 24' ' ' LEU . 57.7 mt -43.12 -41.5 3.68 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.65 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.45 ' CG2' HD13 ' A' ' 59' ' ' LEU . 2.2 t -78.66 -59.11 3.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.573 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.9 -28.56 9.89 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 118.877 -1.129 . . . . 0.0 109.435 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 34.3 mtp -91.0 96.32 10.56 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 119.549 -0.86 . . . . 0.0 111.078 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' N ' ' A' ' 37' ' ' LEU . 60.4 p -54.15 178.47 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.915 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 67.4 t -50.04 -61.05 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 119.599 -0.84 . . . . 0.0 111.346 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.9 ttp180 -51.01 -43.48 60.85 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.583 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -72.63 -30.97 64.78 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.208 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 33' ' ' SER . 56.2 tp -73.86 -43.65 57.94 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.949 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.411 ' O ' HD11 ' A' ' 41' ' ' LEU . 68.3 m-20 -65.69 -7.41 15.28 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.119 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.68 -12.83 38.38 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.762 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -98.1 -35.52 10.38 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.475 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.643 ' CB ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -77.94 14.21 1.18 Allowed 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 118.68 -1.208 . . . . 0.0 112.149 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.573 ' N ' HD12 ' A' ' 41' ' ' LEU . 36.2 mtp85 -51.21 90.1 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.825 -1.15 . . . . 0.0 110.776 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 128.92 4.51 5.12 Favored Glycine 0 N--CA 1.484 1.861 0 C-N-CA 119.925 -1.131 . . . . 0.0 110.72 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.643 HD12 ' CB ' ' A' ' 41' ' ' LEU . 20.9 mt -85.15 147.18 26.74 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.126 -1.43 . . . . 0.0 110.975 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.481 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 14.8 t -80.31 175.41 10.68 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.345 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.656 ' CD ' ' H ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -60.26 -38.19 82.76 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.22 -0.992 . . . . 0.0 110.746 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -82.12 -18.0 44.47 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.502 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.481 ' HB2' ' H ' ' A' ' 45' ' ' SER . 2.4 mt-10 -87.62 -23.75 24.17 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.247 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.522 HG12 HD22 ' A' ' 41' ' ' LEU . 42.0 mt -80.65 -32.28 12.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.292 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.099 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.52 -58.72 5.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.401 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -52.83 -33.64 50.33 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.514 -0.874 . . . . 0.0 110.802 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.22 -33.37 43.77 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.236 -0.985 . . . . 0.0 110.549 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -80.93 -14.64 57.8 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.369 -0.933 . . . . 0.0 110.621 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.31 -63.2 1.16 Allowed 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 119.356 -0.938 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.449 ' O ' ' N ' ' A' ' 58' ' ' THR . 70.9 mtt180 -45.92 -50.96 14.03 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.316 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -44.48 -38.32 4.03 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.285 -0.966 . . . . 0.0 110.444 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.5 tpt85 -75.12 -31.62 61.17 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.103 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.449 ' N ' ' O ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -68.02 -38.54 82.68 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.349 -0.941 . . . . 0.0 110.217 179.957 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.45 HD13 ' CG2' ' A' ' 30' ' ' VAL . 25.4 mt -65.21 -43.94 89.9 Favored 'General case' 0 C--N 1.306 -1.314 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.78 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -59.62 -22.36 61.73 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.944 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -95.86 -48.02 5.9 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.526 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -57.07 -175.86 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.028 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -45.59 -46.33 12.59 Favored Glycine 0 N--CA 1.49 2.289 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.304 -1.376 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.367 -179.95 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.764 ' CD1' ' H ' ' A' ' 25' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.212 -0.886 0 CA-C-O 121.371 0.605 . . . . 0.0 110.701 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.764 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -175.81 162.0 2.6 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.634 -179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.562 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -71.54 -46.94 58.13 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.105 -1.038 . . . . 0.0 109.998 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -20.19 39.26 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.266 -0.974 . . . . 0.0 109.852 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 30' ' ' VAL . 2.4 mt-10 -77.7 -47.21 19.71 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.795 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 28' ' ' GLU . 24.1 mt -39.68 -29.77 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.64 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.485 ' CG2' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -89.37 -63.05 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.626 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.636 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.41 -28.86 1.48 Allowed 'General case' 0 C--N 1.301 -1.502 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.042 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 6.1 mtp -88.07 91.07 8.64 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.226 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.425 ' O ' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -41.34 154.59 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.968 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -39.87 -38.29 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.054 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.457 ' HE ' ' CD ' ' A' ' 36' ' ' GLU . 34.5 ttp180 -62.45 -46.68 87.44 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.032 -1.067 . . . . 0.0 109.839 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.457 ' CD ' ' HE ' ' A' ' 35' ' ' ARG . 2.9 mp0 -67.67 -37.95 83.07 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.326 -0.949 . . . . 0.0 109.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.86 -46.75 77.32 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.654 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -57.24 -19.83 23.76 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.17 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.41 -35.34 35.33 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.531 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.61 -37.22 42.83 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.861 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.65 ' C ' ' H ' ' A' ' 43' ' ' GLY . 49.2 mt -54.73 -13.7 1.12 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.026 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -69.9 27.7 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.361 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.65 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -144.57 -3.16 0.73 Allowed Glycine 0 C--N 1.292 -1.896 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.1 mt -107.74 149.9 27.61 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 119.813 -0.755 . . . . 0.0 111.041 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.35 152.52 30.39 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.288 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.543 ' HA ' HD12 ' A' ' 49' ' ' ILE . 6.7 pttt -46.43 -28.16 1.29 Allowed 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.833 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -82.46 -38.86 23.36 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.635 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -77.16 -15.1 59.66 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.056 -1.058 . . . . 0.0 109.628 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 46' ' ' LYS . 57.6 mt -80.45 -39.07 18.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 C-N-CA 119.544 -0.862 . . . . 0.0 109.697 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.489 HG22 ' N ' ' A' ' 51' ' ' GLN . 9.5 mt -62.9 -62.27 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.275 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.489 ' N ' HG22 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -45.77 -28.97 1.16 Allowed 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.875 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.44 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -78.56 -41.78 31.08 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.246 -0.982 . . . . 0.0 110.898 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.5 mttp -50.25 -20.34 1.02 Allowed 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.616 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.422 ' O ' ' N ' ' A' ' 57' ' ' ARG . 37.9 tt0 -74.22 -73.13 0.24 Allowed 'General case' 0 C--N 1.301 -1.514 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.785 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 58' ' ' THR . 4.8 mmp_? -43.15 -51.64 5.87 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.591 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -45.71 -36.48 5.01 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.808 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 54' ' ' GLN . 13.0 ttt85 -71.17 -27.96 63.9 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.647 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.483 ' N ' ' O ' ' A' ' 55' ' ' ARG . 23.8 m -72.21 -42.63 65.56 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.485 HD13 ' CG2' ' A' ' 30' ' ' VAL . 36.7 mt -60.91 -57.97 10.39 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 118.733 -1.187 . . . . 0.0 110.498 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.41 -13.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.426 -0.909 . . . . 0.0 111.23 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.413 ' N ' ' C ' ' A' ' 59' ' ' LEU . 6.1 t-20 -91.94 -62.2 1.47 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 119.338 -0.945 . . . . 0.0 112.133 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 64' ' ' TYR . 7.6 ptm180 -51.61 173.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.26 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -39.06 -30.45 0.12 Allowed Glycine 0 N--CA 1.498 2.775 0 C-N-CA 119.889 -1.148 . . . . 0.0 110.462 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.436 ' N ' ' O ' ' A' ' 62' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.302 -1.486 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.158 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.675 ' CD1' ' CD2' ' A' ' 40' ' ' HIS . 6.0 mt . . . . . 0 CA--C 1.501 -0.913 0 CA-C-O 121.146 0.498 . . . . 0.0 110.683 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.503 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -58.06 -174.03 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.143 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.621 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -59.84 -56.89 16.12 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.752 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.672 ' O ' HG23 ' A' ' 31' ' ' THR . 6.6 mp0 -64.33 -22.57 67.0 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.51 ' O ' ' CG ' ' A' ' 32' ' ' MET . 10.3 mm-40 -83.54 -9.74 58.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.207 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 56' ' ' ARG . 13.8 mt -87.33 -24.75 24.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.434 -0.907 . . . . 0.0 111.141 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.699 HG21 ' HB3' ' A' ' 59' ' ' LEU . 6.5 t -101.95 -39.78 6.79 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.066 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.672 HG23 ' O ' ' A' ' 27' ' ' GLU . 0.8 OUTLIER -45.53 -46.61 14.09 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.51 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -94.44 133.72 37.73 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.052 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 83.5 p -64.72 -150.63 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.963 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -84.12 -42.35 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 119.339 -0.945 . . . . 0.0 111.302 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -56.57 -43.53 80.1 Favored 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.207 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.522 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 8.9 mp0 -70.0 -26.47 64.08 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.344 -0.943 . . . . 0.0 109.918 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 24' ' ' LEU . 36.6 tp -76.12 -54.48 6.77 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.352 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.762 HD22 ' N ' ' A' ' 38' ' ' ASN . 0.7 OUTLIER -58.89 -11.26 3.1 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.395 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.409 ' N ' ' C ' ' A' ' 37' ' ' LEU . 1.7 tt0 -76.24 -38.86 55.77 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.85 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.675 ' CD2' ' CD1' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -90.55 -37.42 13.86 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.221 -0.992 . . . . 0.0 110.562 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.822 HD23 HD12 ' A' ' 44' ' ' LEU . 18.0 mt -45.94 -34.68 4.09 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.519 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.6 mtp180 -49.94 91.31 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.071 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 143.92 -15.53 2.17 Favored Glycine 0 C--N 1.295 -1.74 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.822 HD12 HD23 ' A' ' 41' ' ' LEU . 18.9 mt -90.44 140.29 29.86 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 119.114 -1.035 . . . . 0.0 110.682 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.0 m -56.18 -178.24 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.565 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.526 ' O ' HD13 ' A' ' 50' ' ' ILE . 21.6 mmtt -77.25 -21.0 54.4 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -89.15 -29.47 19.31 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.921 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.39 -14.51 59.36 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.132 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.49 HG12 HD22 ' A' ' 41' ' ' LEU . 8.4 mt -83.9 -43.06 17.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.446 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.526 HD13 ' O ' ' A' ' 46' ' ' LYS . 1.5 mp -62.76 -56.97 14.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.666 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.893 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.494 ' N ' HG22 ' A' ' 50' ' ' ILE . 9.1 pt20 -51.36 -29.86 16.79 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.851 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.443 ' N ' ' HG3' ' A' ' 51' ' ' GLN . 1.2 mp -81.11 -25.79 36.7 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.933 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -81.62 -9.17 59.73 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.016 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -81.33 -75.14 0.3 Allowed 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.032 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -44.59 -42.38 7.31 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.279 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.432 ' HB2' HD22 ' A' ' 29' ' ' LEU . 7.7 ttt-85 -50.52 -41.44 53.72 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.16 -1.016 . . . . 0.0 109.748 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.485 HH11 ' HG2' ' A' ' 57' ' ' ARG . 57.7 mmt-85 -74.96 -31.59 61.5 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.278 -0.969 . . . . 0.0 110.063 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.0 m -67.16 -38.14 84.96 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.337 -0.945 . . . . 0.0 110.409 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.699 ' HB3' HG21 ' A' ' 30' ' ' VAL . 19.3 mt -67.71 -34.33 76.65 Favored 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 119.277 -0.969 . . . . 0.0 110.639 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HZ2' ' HB3' ' A' ' 60' ' ' LYS . 10.6 mtpp -67.46 -15.17 63.52 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.54 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -97.04 -49.1 5.14 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.748 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.48 ' O ' ' N ' ' A' ' 64' ' ' TYR . 57.9 ttt-85 -51.38 169.44 0.05 Allowed 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.424 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.48 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -41.62 -23.45 0.11 Allowed Glycine 0 N--CA 1.493 2.456 0 C-N-CA 119.608 -1.282 . . . . 0.0 110.949 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.48 ' N ' ' O ' ' A' ' 62' ' ' ARG . 6.1 t80 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.104 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.44 ' HA ' HD12 ' A' ' 24' ' ' LEU . 1.2 tp . . . . . 0 C--O 1.216 -0.7 0 CA-C-O 122.179 0.99 . . . . 0.0 110.073 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.471 ' N ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -59.54 163.86 3.88 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.777 179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.09 -41.66 26.79 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.64 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.861 ' O ' HG23 ' A' ' 31' ' ' THR . 30.2 mt-10 -70.74 -32.42 69.58 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.713 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.495 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 1.6 mp0 -66.21 -35.35 80.2 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.414 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 mt -60.25 -29.25 68.66 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.693 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.82 HG21 ' HB3' ' A' ' 59' ' ' LEU . 17.1 t -92.66 -42.78 13.5 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.167 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.844 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.861 HG23 ' O ' ' A' ' 27' ' ' GLU . 22.4 p -46.05 -37.29 6.54 Favored 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.591 -1.244 . . . . 0.0 107.803 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 12.6 ptm -92.92 123.84 36.47 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.856 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -66.05 -177.47 0.5 Allowed 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 119.019 -1.072 . . . . 0.0 110.793 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.522 ' O ' ' N ' ' A' ' 37' ' ' LEU . 44.7 t -62.23 -55.17 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.672 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -47.31 -30.02 2.88 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 118.696 -1.202 . . . . 0.0 109.432 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -85.37 -26.49 26.45 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.301 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.591 HD13 ' HE ' ' A' ' 56' ' ' ARG . 5.0 tp -74.63 -41.21 60.79 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.149 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -51.08 -37.21 44.34 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.953 -1.099 . . . . 0.0 109.484 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.21 -37.29 77.09 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.105 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.8 -45.57 16.73 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.735 HD22 HG12 ' A' ' 49' ' ' ILE . 30.5 mt -50.22 -29.11 8.75 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.486 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -52.1 88.77 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.339 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 139.7 -13.27 3.17 Favored Glycine 0 N--CA 1.481 1.678 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.2 mt -97.74 137.47 36.57 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.83 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.513 ' H ' ' HB2' ' A' ' 48' ' ' GLU . 0.4 OUTLIER -89.34 173.25 8.48 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.584 -0.846 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.5 mmtt -45.99 -46.91 16.68 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.26 -31.78 70.55 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.981 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.513 ' HB2' ' H ' ' A' ' 45' ' ' SER . 23.9 mt-10 -83.42 -21.5 32.96 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.735 HG12 HD22 ' A' ' 41' ' ' LEU . 2.3 mt -82.42 -34.74 12.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.004 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 22.8 mt -59.49 -57.09 13.07 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.583 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.431 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 4.2 mm100 -42.07 -31.21 0.34 Allowed 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.168 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.5 ' C ' ' H ' ' A' ' 54' ' ' GLN . 34.2 mt -88.26 -32.86 18.3 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -64.74 4.87 0.36 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.356 -0.938 . . . . 0.0 111.008 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 52' ' ' LEU . 6.3 tt0 -99.21 -89.16 0.32 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.486 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 54' ' ' GLN . 12.4 tpt180 -43.65 -50.55 7.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.688 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.591 ' HE ' HD13 ' A' ' 37' ' ' LEU . 64.7 ttt-85 -48.98 -31.18 7.01 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.766 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 54' ' ' GLN . 0.2 OUTLIER -76.67 -32.15 57.75 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.644 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 m -69.59 -41.71 75.4 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.962 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.82 ' HB3' HG21 ' A' ' 30' ' ' VAL . 40.8 mt -70.72 -35.29 72.63 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.134 -1.026 . . . . 0.0 110.616 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.7 mmmt -72.6 -13.22 61.33 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.583 -0.847 . . . . 0.0 111.517 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -91.55 -67.01 0.88 Allowed 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.16 -1.016 . . . . 0.0 112.155 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HG3' ' H ' ' A' ' 64' ' ' TYR . 4.0 ptm180 -51.11 173.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.523 -0.871 . . . . 0.0 111.49 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -36.32 -35.73 0.12 Allowed Glycine 0 N--CA 1.5 2.947 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.289 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.543 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--N 1.301 -1.514 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.424 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.824 HD11 ' SD ' ' A' ' 32' ' ' MET . 9.1 tp . . . . . 0 C--O 1.216 -0.691 0 CA-C-O 121.857 0.837 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.7 p -51.3 169.31 0.05 Allowed 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.34 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.89 -8.58 55.24 Favored 'General case' 0 C--N 1.299 -1.603 0 C-N-CA 118.897 -1.121 . . . . 0.0 110.5 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' O ' ' OG1' ' A' ' 31' ' ' THR . 18.3 mt-10 -90.17 -14.54 33.32 Favored 'General case' 0 C--N 1.295 -1.798 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.237 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' LEU . 33.6 mm-40 -90.92 -48.87 6.75 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 119.857 -0.737 . . . . 0.0 112.014 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' A' ' 28' ' ' GLU . 14.5 mt -39.66 -46.42 1.83 Allowed 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 119.819 -0.753 . . . . 0.0 111.536 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.639 HG13 ' CG ' ' A' ' 60' ' ' LYS . 12.0 t -70.78 -57.64 7.28 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.392 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.233 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -51.7 -20.22 1.98 Allowed 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 118.597 -1.241 . . . . 0.0 109.444 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.824 ' SD ' HD11 ' A' ' 24' ' ' LEU . 75.2 mtp -89.98 90.61 8.23 Favored 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.646 -0.821 . . . . 0.0 110.666 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 p -49.0 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.746 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 61.1 t -139.88 -26.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 C-N-CA 119.876 -0.73 . . . . 0.0 110.307 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.484 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -76.81 -41.29 44.96 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.781 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 4.4 tp10 -76.34 -29.96 57.44 Favored 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.431 -0.908 . . . . 0.0 109.514 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.1 tp -71.44 -43.52 66.54 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.878 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -58.47 -33.97 70.36 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 119.209 -0.996 . . . . 0.0 110.316 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -33.55 68.87 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' HD11 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -93.01 -35.48 13.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.516 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.604 HD23 HD12 ' A' ' 44' ' ' LEU . 40.4 mt -62.7 -15.58 53.4 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.135 -1.026 . . . . 0.0 110.991 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -70.34 39.76 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.958 -1.097 . . . . 0.0 110.261 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.586 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -158.72 -2.49 0.07 OUTLIER Glycine 0 C--N 1.293 -1.807 0 N-CA-C 108.793 -1.723 . . . . 0.0 108.793 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 41' ' ' LEU . 22.3 mt -107.02 157.38 17.86 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 119.831 -0.748 . . . . 0.0 110.911 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.27 -176.04 4.97 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.803 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -66.66 -39.7 88.29 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.811 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.25 -36.5 69.07 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.801 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -74.08 -19.26 60.66 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.454 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mt -80.89 -38.93 17.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.722 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.8 mt -65.31 -50.56 72.6 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.328 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.946 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -54.12 -40.84 67.71 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.288 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.449 HD22 ' CD1' ' A' ' 44' ' ' LEU . 1.7 mp -74.15 -37.49 64.02 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.293 -0.963 . . . . 0.0 110.246 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.56 -29.64 69.28 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.991 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -86.36 -45.16 11.46 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.384 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 -51.54 -61.57 2.16 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 119.256 -0.978 . . . . 0.0 109.936 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.503 ' C ' ' CD ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -47.28 -31.03 3.47 Favored 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 118.924 -1.11 . . . . 0.0 109.217 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.64 -37.96 48.88 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.764 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -60.47 -42.17 95.68 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.338 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.546 HD13 HG23 ' A' ' 30' ' ' VAL . 13.2 mt -54.83 -47.46 74.08 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.592 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.639 ' CG ' HG13 ' A' ' 30' ' ' VAL . 39.2 mtpt -71.28 4.95 2.47 Favored 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.286 -0.966 . . . . 0.0 110.689 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -139.65 19.16 2.52 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.673 -0.811 . . . . 0.0 111.477 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 63' ' ' GLY . 35.3 ttt180 -137.1 -111.24 0.18 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.121 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.46 ' N ' ' HG2' ' A' ' 62' ' ' ARG . . . -73.87 -75.47 0.76 Allowed Glycine 0 N--CA 1.491 2.309 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.926 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--N 1.304 -1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 111.225 -179.915 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.51 ' C ' ' CD1' ' A' ' 24' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.237 0.542 . . . . 0.0 109.905 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.11 149.51 27.97 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.203 -0.999 . . . . 0.0 110.559 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -48.11 -40.73 24.43 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.826 -1.149 . . . . 0.0 109.941 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.21 -24.69 63.35 Favored 'General case' 0 C--N 1.299 -1.624 0 C-N-CA 119.444 -0.903 . . . . 0.0 111.214 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.49 -40.46 29.66 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.259 -0.976 . . . . 0.0 111.061 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.513 ' HA ' HD23 ' A' ' 29' ' ' LEU . 13.9 mt -43.15 -34.27 1.06 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.593 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.551 ' CG2' HD13 ' A' ' 59' ' ' LEU . 1.6 t -85.88 -63.41 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.728 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.301 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.26 -28.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 118.998 -1.081 . . . . 0.0 110.145 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 9.0 mtp -88.23 91.59 8.84 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.223 -0.991 . . . . 0.0 110.507 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.506 ' O ' ' N ' ' A' ' 37' ' ' LEU . 2.6 p -55.39 -178.76 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.899 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.466 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 45.6 t -49.58 -52.68 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 111.2 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -54.72 -54.21 44.87 Favored 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.127 -1.029 . . . . 0.0 110.457 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -67.08 -30.3 70.29 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.415 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 33' ' ' SER . 9.7 tp -74.3 -39.89 62.62 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.173 -1.011 . . . . 0.0 110.109 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.504 HD22 ' N ' ' A' ' 38' ' ' ASN . 1.0 OUTLIER -58.98 -20.47 53.08 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.569 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -72.0 -31.14 65.94 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.53 -43.49 10.19 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.155 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.884 HD22 HD13 ' A' ' 49' ' ' ILE . 19.0 mt -45.94 -47.52 16.46 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 119.539 -0.864 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 41' ' ' LEU . 4.5 mtp85 -41.78 94.52 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.571 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 141.16 -19.45 2.68 Favored Glycine 0 C--N 1.296 -1.646 0 N-CA-C 109.065 -1.614 . . . . 0.0 109.065 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.795 HD12 HD23 ' A' ' 41' ' ' LEU . 19.3 mt -84.82 147.51 26.78 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.621 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.417 ' O ' ' N ' ' A' ' 48' ' ' GLU . 52.8 p -76.61 151.91 36.08 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.742 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.554 ' H ' ' HD2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -45.6 -35.71 4.21 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.268 -0.973 . . . . 0.0 110.603 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -77.7 -31.14 52.17 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.283 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 45' ' ' SER . 5.8 tt0 -77.94 -20.52 52.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.041 -1.064 . . . . 0.0 109.12 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.884 HD13 HD22 ' A' ' 41' ' ' LEU . 1.6 mm -72.83 -46.46 52.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.585 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 mt -58.81 -56.02 19.42 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -54.8 -37.97 66.73 Favored 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.41 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.26 -39.77 65.15 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.094 -1.042 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.7 mmmp? -62.39 -11.57 16.43 Favored 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.841 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -84.48 -56.53 3.57 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.406 ' H ' ' HG2' ' A' ' 55' ' ' ARG . 15.1 mmt180 -55.52 -51.39 67.2 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.068 -1.053 . . . . 0.0 110.027 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -49.54 -38.12 29.55 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.995 -1.082 . . . . 0.0 109.697 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -33.55 67.18 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.983 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.464 ' O ' ' N ' ' A' ' 62' ' ' ARG . 96.0 m -64.09 -41.51 97.27 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.217 -0.993 . . . . 0.0 110.485 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.551 HD13 ' CG2' ' A' ' 30' ' ' VAL . 31.7 mt -54.49 -60.35 3.47 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.25 -0.98 . . . . 0.0 110.754 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp -47.57 -20.47 0.26 Allowed 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.444 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -106.25 -29.66 9.67 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.594 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' THR . 15.3 ttt180 -76.39 -147.54 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.032 -1.067 . . . . 0.0 111.483 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.456 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -57.73 -61.01 7.95 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.829 -1.176 . . . . 0.0 111.611 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--N 1.305 -1.344 0 C-N-CA 119.172 -1.011 . . . . 0.0 111.546 -179.868 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.54 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.95 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.512 ' H ' ' HG3' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -80.38 -157.36 0.15 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.131 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -76.85 -53.73 7.52 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.972 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.766 ' O ' HG23 ' A' ' 31' ' ' THR . 63.1 mt-10 -62.4 -24.28 67.31 Favored 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 118.96 -1.096 . . . . 0.0 109.206 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 25' ' ' THR . 37.1 mm-40 -63.87 -29.67 70.83 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.486 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.71 -45.72 74.29 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.696 0.76 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.809 HG21 ' HB3' ' A' ' 59' ' ' LEU . 41.4 t -78.42 -44.19 26.58 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.186 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.006 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.766 HG23 ' O ' ' A' ' 27' ' ' GLU . 6.6 p -51.09 -35.39 34.85 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 10.3 mtm -92.52 123.58 35.92 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.549 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -162.86 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.247 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.99 -48.95 36.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.108 -1.037 . . . . 0.0 110.944 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -61.83 -31.25 71.47 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.604 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -77.42 -36.9 52.79 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.222 -0.991 . . . . 0.0 109.928 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.9 tp -74.49 -42.89 58.19 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.105 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -63.23 -14.36 48.36 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.944 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.09 -32.03 64.72 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.486 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.477 ' NE2' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -99.09 -27.13 13.98 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.685 -0.806 . . . . 0.0 111.226 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.697 HD23 HD12 ' A' ' 44' ' ' LEU . 17.5 mt -54.05 -33.53 57.67 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 119.218 -0.993 . . . . 0.0 111.765 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.489 ' CB ' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -63.61 78.26 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.386 -179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 165.76 -14.61 0.08 OUTLIER Glycine 0 C--N 1.296 -1.679 0 N-CA-C 109.134 -1.586 . . . . 0.0 109.134 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.697 HD12 HD23 ' A' ' 41' ' ' LEU . 22.4 mt -88.93 152.67 21.58 Favored 'General case' 0 C--N 1.311 -1.102 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 46' ' ' LYS . 11.1 t -74.19 155.19 38.62 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.206 -0.998 . . . . 0.0 110.315 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 45' ' ' SER . 1.0 OUTLIER -41.78 -43.24 2.87 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.504 -0.878 . . . . 0.0 111.202 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.69 -48.35 72.36 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.335 -0.946 . . . . 0.0 111.103 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.3 OUTLIER -62.52 -22.62 66.43 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.698 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mm -76.01 -43.15 38.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.749 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.9 mt -69.55 -40.41 79.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 C-N-CA 118.986 -1.085 . . . . 0.0 109.339 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -57.56 -49.25 76.98 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.878 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.57 ' C ' ' H ' ' A' ' 54' ' ' GLN . 6.0 mp -69.97 -42.31 73.32 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 111.245 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.436 ' HD2' HH21 ' A' ' 56' ' ' ARG . 0.5 OUTLIER -61.17 5.54 0.06 Allowed 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.018 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 52' ' ' LEU . 30.2 tt0 -100.32 -76.34 0.56 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.291 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -42.71 -47.84 5.46 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.351 -0.94 . . . . 0.0 110.506 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.436 HH21 ' HD2' ' A' ' 53' ' ' LYS . 4.2 tmm_? -45.72 -36.22 4.84 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.206 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.651 ' CA ' ' HE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -74.82 -34.29 62.32 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.46 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.46 ' N ' ' HG3' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -77.74 -36.97 50.24 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.536 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.809 ' HB3' HG21 ' A' ' 30' ' ' VAL . 20.4 mt -62.53 -21.12 65.3 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.315 -0.954 . . . . 0.0 111.409 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.51 ' HA ' ' HZ2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -90.41 0.97 57.06 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -121.49 -33.32 3.66 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.665 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -65.94 -149.1 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 C-N-CA 119.425 -0.91 . . . . 0.0 110.582 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -69.21 -27.57 73.6 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.379 -1.391 . . . . 0.0 110.369 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.9 t80 . . . . . 0 C--N 1.308 -1.237 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.949 -179.946 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.571 HD11 HD21 ' A' ' 29' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 121.312 0.577 . . . . 0.0 110.513 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.14 -174.48 3.67 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.437 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -52.43 51.05 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.355 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -56.07 -38.23 70.38 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.861 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -46.88 71.24 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.922 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.571 HD21 HD11 ' A' ' 24' ' ' LEU . 69.7 mt -47.7 -39.67 18.13 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.573 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.428 ' C ' ' N ' ' A' ' 32' ' ' MET . 2.0 t -79.25 -58.95 3.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.915 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.76 -26.66 0.69 Allowed 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 118.838 -1.145 . . . . 0.0 109.09 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.428 ' N ' ' C ' ' A' ' 30' ' ' VAL . 62.7 mtp -91.05 97.85 11.41 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.923 -1.035 . . . . 0.0 109.993 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.3 m -48.94 -94.27 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 C-N-CA 119.821 -0.752 . . . . 0.0 111.58 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 60.8 t -140.58 -31.59 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.593 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.5 ptt-85 -76.86 -23.76 52.65 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.897 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.34 -31.37 18.95 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.891 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tp -74.35 -39.59 62.69 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.272 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -61.67 -14.84 34.82 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.907 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -89.99 0.04 57.32 Favored 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.496 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.42 ' CE1' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -113.38 -29.21 7.3 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.373 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.601 HD12 ' N ' ' A' ' 42' ' ' ARG . 0.2 OUTLIER -84.01 3.36 34.73 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.469 -1.293 . . . . 0.0 112.789 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.601 ' N ' HD12 ' A' ' 41' ' ' LEU . 5.8 mtm180 -50.86 90.68 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.999 -1.08 . . . . 0.0 110.743 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 132.65 0.37 4.44 Favored Glycine 0 N--CA 1.482 1.76 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.8 mt -89.77 124.94 35.08 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 118.719 -1.193 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.6 m -60.36 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.326 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.483 ' O ' HD13 ' A' ' 50' ' ' ILE . 3.3 tmtm? -73.88 -38.21 64.48 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.765 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.733 ' CD ' ' H ' ' A' ' 47' ' ' GLU . 9.9 pm0 -83.15 -11.62 57.75 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.044 -1.062 . . . . 0.0 110.565 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.61 -21.68 21.6 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 119.388 -0.925 . . . . 0.0 110.176 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.513 HG22 HD12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -77.86 -27.7 15.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 C-N-CA 119.424 -0.911 . . . . 0.0 109.627 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.513 HD12 HG22 ' A' ' 49' ' ' ILE . 1.4 mp -70.29 -33.4 54.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.534 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.422 ' H ' ' HG2' ' A' ' 51' ' ' GLN . 10.8 mm100 -58.03 -43.09 86.58 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.563 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 52' ' ' LEU . 4.4 mm? -69.49 -35.79 75.89 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.681 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HD3' HH21 ' A' ' 56' ' ' ARG . 15.0 mmtp -64.47 -0.52 1.36 Allowed 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.387 -0.925 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.416 ' H ' ' C ' ' A' ' 52' ' ' LEU . 7.0 tp60 -86.46 -79.56 0.26 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.963 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -54.08 -38.0 64.83 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.039 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.438 HH21 ' HD3' ' A' ' 53' ' ' LYS . 45.9 ttp85 -59.08 -31.27 68.74 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.013 -1.075 . . . . 0.0 109.724 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -79.43 -28.45 41.71 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 119.212 -0.995 . . . . 0.0 110.3 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.9 m -71.05 -34.72 71.5 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.294 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.415 ' HB3' HG21 ' A' ' 30' ' ' VAL . 65.3 mt -69.87 -48.61 58.1 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.163 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -63.15 -10.6 15.63 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.644 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -89.4 -62.84 1.39 Allowed 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.395 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -53.36 178.21 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.608 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.409 ' C ' ' O ' ' A' ' 62' ' ' ARG . . . -40.09 -32.49 0.39 Allowed Glycine 0 N--CA 1.495 2.599 0 C-N-CA 119.844 -1.17 . . . . 0.0 110.62 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 7.6 t80 . . . . . 0 C--N 1.306 -1.292 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.429 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.474 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 121.108 0.48 . . . . 0.0 110.438 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -169.47 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.761 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.678 ' HB3' HD11 ' A' ' 59' ' ' LEU . 29.2 m-20 -73.3 -58.04 3.59 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.101 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -52.67 -8.56 0.09 Allowed 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.998 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.532 ' H ' ' C ' ' A' ' 26' ' ' ASP . 2.2 mt-10 -90.57 -32.63 16.21 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.641 -0.824 . . . . 0.0 111.424 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.463 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 92.4 mt -65.45 -23.97 67.06 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.73 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.693 HG21 ' HB3' ' A' ' 59' ' ' LEU . 2.9 t -96.63 -59.92 2.93 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.006 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.264 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.463 ' CG2' ' N ' ' A' ' 32' ' ' MET . 14.6 t -41.43 -32.63 0.34 Allowed 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 118.989 -1.084 . . . . 0.0 108.688 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.515 ' SD ' ' O ' ' A' ' 28' ' ' GLU . 14.6 ptm -91.06 119.24 31.05 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.415 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 34' ' ' VAL . 41.3 t -57.86 -174.85 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.471 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.503 ' N ' ' OG ' ' A' ' 33' ' ' SER . 48.7 t -68.97 -46.18 79.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 C-N-CA 119.255 -0.978 . . . . 0.0 110.672 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -50.69 -46.39 58.78 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.174 -1.01 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.96 -25.36 63.6 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.179 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.464 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -78.94 -49.33 12.98 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.236 -0.986 . . . . 0.0 109.348 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.45 ' ND2' HG12 ' A' ' 34' ' ' VAL . 69.3 m-20 -59.6 -16.98 29.46 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.913 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -78.0 -33.46 51.25 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.361 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.461 ' C ' ' N ' ' A' ' 42' ' ' ARG . 0.7 OUTLIER -89.47 -45.16 9.63 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.364 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.617 HD13 HG23 ' A' ' 49' ' ' ILE . 42.4 mt -46.26 -18.9 0.06 Allowed 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.703 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' N ' ' C ' ' A' ' 40' ' ' HIS . 1.4 ttp180 -56.35 -10.03 0.82 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.418 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.43 ' N ' ' C ' ' A' ' 41' ' ' LEU . . . -103.76 -1.78 46.17 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.8 mt -110.31 153.51 24.78 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 119.595 -0.842 . . . . 0.0 111.05 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.413 ' O ' ' N ' ' A' ' 48' ' ' GLU . 66.4 m -84.3 154.63 22.83 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.796 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -44.61 -36.33 3.01 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.792 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -80.27 -30.2 38.36 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.589 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 tp10 -81.9 -17.01 48.7 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.529 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.617 HG23 HD13 ' A' ' 41' ' ' LEU . 70.0 mt -82.06 -33.8 11.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 119.681 -0.808 . . . . 0.0 109.819 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.3 mt -61.21 -59.32 4.46 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.814 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -51.36 -31.14 21.14 Favored 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.139 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.429 ' HA ' HD12 ' A' ' 52' ' ' LEU . 9.1 tp -83.66 -16.15 46.16 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.422 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -81.13 -27.35 35.56 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.122 -1.031 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -68.04 -64.25 0.9 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.192 -1.003 . . . . 0.0 110.392 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -43.55 -54.01 5.2 Favored 'General case' 0 C--N 1.307 -1.274 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.36 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.419 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 10.9 ttt180 -42.5 -35.93 1.2 Allowed 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.95 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.2 tpt85 -72.55 -31.75 65.52 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.416 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 55' ' ' ARG . 17.6 m -67.5 -33.21 74.64 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.094 -1.042 . . . . 0.0 110.295 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.693 ' HB3' HG21 ' A' ' 30' ' ' VAL . 26.7 mt -68.18 -36.26 79.32 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.222 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -57.16 -16.84 8.79 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.42 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.468 ' C ' ' ND2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -87.91 -53.6 4.66 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 119.218 -0.993 . . . . 0.0 110.936 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.439 ' N ' HD22 ' A' ' 61' ' ' ASN . 0.4 OUTLIER -51.06 171.15 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.933 -179.979 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -44.03 -39.28 5.07 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 119.365 -1.398 . . . . 0.0 110.004 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.302 -1.457 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.187 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.526 HD23 ' CD2' ' A' ' 29' ' ' LEU . 6.2 tp . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 121.728 0.775 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.97 161.35 0.07 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.193 -1.003 . . . . 0.0 110.958 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.55 ' CB ' HD11 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -65.15 -41.5 94.65 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.918 179.879 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -59.66 -18.66 43.75 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.818 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -91.18 -55.1 3.66 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.266 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.526 ' CD2' HD23 ' A' ' 24' ' ' LEU . 55.0 mt -37.78 -47.91 1.05 Allowed 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 120.247 -0.581 . . . . 0.0 111.983 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.468 ' CG2' HD13 ' A' ' 59' ' ' LEU . 2.3 t -67.27 -57.25 10.49 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.974 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.184 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.62 -27.84 12.51 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 118.577 -1.249 . . . . 0.0 108.854 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.414 ' CE ' HD21 ' A' ' 24' ' ' LEU . 3.2 mtp -91.34 100.3 13.11 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.34 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.1 t -59.02 159.61 6.99 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.135 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' LEU . 41.2 t -45.87 -54.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.99 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.1 ttm-85 -47.63 -41.87 23.02 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 118.643 -1.223 . . . . 0.0 109.997 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -76.82 -23.65 52.78 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.722 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 34' ' ' VAL . 14.6 tp -73.37 -46.06 51.24 Favored 'General case' 0 C--N 1.308 -1.239 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.885 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.532 HD22 ' N ' ' A' ' 38' ' ' ASN . 1.0 OUTLIER -49.9 -32.43 14.57 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.059 -1.057 . . . . 0.0 110.788 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.497 ' O ' ' NE ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -62.18 -18.54 61.28 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.801 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CD2' HD22 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -108.57 -21.33 12.76 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.873 -0.731 . . . . 0.0 111.152 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.654 HD23 HD12 ' A' ' 44' ' ' LEU . 31.1 mt -70.13 -23.94 63.1 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.299 -0.96 . . . . 0.0 111.695 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.503 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -62.2 6.95 0.07 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 118.613 -1.235 . . . . 0.0 110.685 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.605 ' H ' ' C ' ' A' ' 41' ' ' LEU . . . -120.53 2.62 12.36 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.654 HD12 HD23 ' A' ' 41' ' ' LEU . 24.1 mt -110.98 155.89 22.04 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 m -77.58 -172.68 2.66 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.333 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.47 ' HG3' ' N ' ' A' ' 47' ' ' GLU . 24.4 pttt -68.19 -49.6 59.79 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.849 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.47 ' N ' ' HG3' ' A' ' 46' ' ' LYS . 13.3 tp10 -69.7 -26.46 64.36 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.745 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -76.91 -19.99 56.75 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.489 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.447 HG12 HD22 ' A' ' 41' ' ' LEU . 9.4 mt -82.25 -43.22 19.22 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 119.214 -0.995 . . . . 0.0 109.936 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 63.3 mt -62.01 -53.48 47.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 C-N-CA 119.423 -0.911 . . . . 0.0 110.28 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -49.74 -45.48 49.43 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.076 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 tp -62.49 -35.58 79.82 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.517 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -65.43 -11.3 41.41 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.248 -0.981 . . . . 0.0 111.253 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -91.0 -45.64 8.6 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 119.199 -1.0 . . . . 0.0 111.324 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -64.05 -56.53 14.3 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 118.836 -1.146 . . . . 0.0 110.237 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 35.6 ttt-85 -50.37 -30.74 12.94 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.988 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.1 tpt85 -77.03 -29.93 55.49 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.417 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 m -69.83 -36.24 75.44 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.867 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.55 HD11 ' CB ' ' A' ' 26' ' ' ASP . 41.7 mt -66.53 -49.07 67.71 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.079 -1.048 . . . . 0.0 110.544 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mmmt -53.58 -18.61 3.02 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.612 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -96.13 -47.49 6.04 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 119.444 -0.902 . . . . 0.0 111.278 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.444 ' HG2' ' H ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -56.63 179.59 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.052 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.444 ' H ' ' HG2' ' A' ' 62' ' ' ARG . . . -42.59 -43.12 4.92 Favored Glycine 0 N--CA 1.493 2.467 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.661 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--N 1.303 -1.421 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.91 -179.917 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.456 HD11 ' SD ' ' A' ' 32' ' ' MET . 5.1 tp . . . . . 0 C--O 1.216 -0.684 0 CA-C-O 122.071 0.939 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.407 ' C ' ' O ' ' A' ' 24' ' ' LEU . 1.2 p -41.97 152.81 0.07 Allowed 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.727 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.609 ' CG ' HH21 ' A' ' 55' ' ' ARG . 10.1 m-20 -52.28 -38.99 59.88 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 118.783 -1.167 . . . . 0.0 110.279 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -62.69 -18.24 62.08 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 119.467 -0.893 . . . . 0.0 111.738 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -90.76 -48.71 6.87 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.876 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.545 HD22 ' HB2' ' A' ' 56' ' ' ARG . 9.7 mt -39.98 -46.99 2.18 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.565 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.492 HG23 HD13 ' A' ' 59' ' ' LEU . 4.2 t -69.33 -61.13 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.079 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.028 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.401 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -46.03 -22.73 0.23 Allowed 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 118.888 -1.125 . . . . 0.0 109.576 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.467 ' N ' ' C ' ' A' ' 30' ' ' VAL . 28.8 mtp -91.17 92.96 8.9 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.453 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 37' ' ' LEU . 1.6 t -53.01 176.25 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.889 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 t -53.69 -62.81 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.821 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.424 ' CG ' ' N ' ' A' ' 36' ' ' GLU . 21.1 ptt180 -50.71 -33.18 21.82 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 118.942 -1.103 . . . . 0.0 110.024 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 35' ' ' ARG . 21.8 mt-10 -78.59 -31.83 47.38 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.614 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.547 HD22 ' HD3' ' A' ' 56' ' ' ARG . 15.9 tp -73.86 -45.26 52.14 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.62 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -54.02 -32.56 54.7 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 118.997 -1.081 . . . . 0.0 110.225 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -27.32 68.28 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.662 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.33 -30.04 14.72 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.653 -0.819 . . . . 0.0 110.757 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 44' ' ' LEU . 44.3 mt -72.46 -32.98 66.7 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.2 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.6 ttt180 -52.82 88.59 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.112 -1.035 . . . . 0.0 110.179 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.557 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 142.03 -15.08 2.59 Favored Glycine 0 C--N 1.297 -1.606 0 N-CA-C 109.309 -1.517 . . . . 0.0 109.309 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.89 HD12 HD23 ' A' ' 41' ' ' LEU . 17.6 mt -84.95 169.4 14.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.679 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.75 154.05 19.82 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.7 tptt -45.23 -58.34 3.33 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.082 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 48' ' ' GLU . 8.4 pt-20 -57.29 -26.45 60.89 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.931 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.454 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 15.6 tp10 -83.87 -25.7 30.04 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 119.089 -1.044 . . . . 0.0 109.878 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.534 HG13 HD22 ' A' ' 41' ' ' LEU . 1.1 mp -71.38 -37.57 65.59 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.755 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.2 mt -60.13 -60.14 3.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.972 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -48.08 -36.96 14.06 Favored 'General case' 0 C--N 1.299 -1.605 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.47 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.458 ' CD1' ' CD1' ' A' ' 44' ' ' LEU . 16.3 mt -85.12 -19.62 31.56 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.132 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -83.99 -3.47 58.02 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.279 -0.969 . . . . 0.0 110.712 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -104.35 -62.35 1.33 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.097 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.609 HH21 ' CG ' ' A' ' 26' ' ' ASP . 3.9 ttt180 -44.8 -54.2 6.61 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.843 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.547 ' HD3' HD22 ' A' ' 37' ' ' LEU . 53.2 ttp85 -46.92 -35.11 6.11 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.076 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.3 ttt-85 -76.11 -34.15 59.48 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 119.266 -0.974 . . . . 0.0 110.274 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -62.78 -37.42 86.58 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.785 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.492 HD13 HG23 ' A' ' 30' ' ' VAL . 27.9 mt -66.03 -46.3 78.36 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.29 -0.964 . . . . 0.0 110.604 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -55.0 -17.47 3.81 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.242 -0.983 . . . . 0.0 110.566 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -95.26 -40.38 9.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.958 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.585 ' CG ' ' H ' ' A' ' 63' ' ' GLY . 40.0 ttp85 -64.14 178.74 0.64 Allowed 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.989 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.585 ' H ' ' CG ' ' A' ' 62' ' ' ARG . . . -44.09 -39.1 5.07 Favored Glycine 0 N--CA 1.492 2.394 0 C-N-CA 119.444 -1.36 . . . . 0.0 110.114 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--N 1.304 -1.395 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.508 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.403 0.62 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.5 p -69.54 156.29 39.13 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 119.526 -0.87 . . . . 0.0 111.051 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.31 -35.6 72.11 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.489 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 3.9 mp0 -63.6 -27.04 68.96 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.282 -0.967 . . . . 0.0 110.506 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' VAL . 3.0 mt-10 -78.13 -49.45 13.86 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.059 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.467 ' HA ' HD23 ' A' ' 29' ' ' LEU . 12.1 mt -37.41 -24.85 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.943 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -99.08 -59.06 3.47 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.345 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -44.56 -45.0 9.18 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.761 -1.176 . . . . 0.0 109.119 179.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.435 ' O ' ' CG ' ' A' ' 32' ' ' MET . 2.7 ptt? -92.31 120.64 33.04 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.111 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.7 p -77.31 -165.55 0.6 Allowed 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.636 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 48.4 t -56.16 -49.83 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.789 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.419 ' H ' ' HG2' ' A' ' 35' ' ' ARG . 21.5 mmm180 -44.37 -51.49 8.51 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.248 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 36' ' ' GLU . 2.6 mp0 -71.97 -30.12 64.94 Favored 'General case' 0 C--N 1.295 -1.799 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.452 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.402 ' HA ' ' CE ' ' A' ' 32' ' ' MET . 2.6 tt -65.82 -45.35 82.62 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.959 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -58.71 -14.94 9.84 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.056 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -15.51 44.26 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.788 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.567 ' NE2' HD13 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -99.25 -46.3 5.58 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.525 -179.835 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.711 HD12 ' N ' ' A' ' 42' ' ' ARG . 0.3 OUTLIER -66.55 5.63 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.496 -179.861 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.711 ' N ' HD12 ' A' ' 41' ' ' LEU . 9.8 mtp85 -44.9 99.24 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.733 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 41' ' ' LEU . . . 107.42 8.62 30.57 Favored Glycine 0 N--CA 1.483 1.813 0 C-N-CA 119.926 -1.13 . . . . 0.0 111.832 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.576 HD12 ' CB ' ' A' ' 41' ' ' LEU . 19.6 mt -84.21 151.4 24.86 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 117.437 -1.705 . . . . 0.0 110.823 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.449 ' OG ' ' OE2' ' A' ' 47' ' ' GLU . 33.7 t -78.54 171.05 15.68 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.631 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -59.87 -40.98 90.51 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.785 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.725 ' CD ' ' H ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -79.49 -16.98 55.12 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.707 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.565 ' HG2' HD22 ' A' ' 44' ' ' LEU . 18.2 tt0 -89.73 -20.34 23.69 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.298 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 48.6 mt -82.89 -35.36 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.593 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.03 -46.32 91.79 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.273 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.239 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.76 -50.47 63.43 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.09 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.567 HD13 ' NE2' ' A' ' 40' ' ' HIS . 27.8 mt -67.61 -20.07 65.31 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.917 -1.113 . . . . 0.0 110.387 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.26 -19.94 38.58 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.658 -0.817 . . . . 0.0 110.436 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -76.62 -59.1 2.91 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.652 -0.819 . . . . 0.0 111.034 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.9 mmt-85 -55.57 -46.86 77.13 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.356 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.455 ' NH2' ' HE3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -51.28 -35.66 38.53 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.804 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.66 -35.77 70.44 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.717 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 17.1 m -58.88 -44.31 91.12 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.069 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.404 HD13 ' CG2' ' A' ' 30' ' ' VAL . 44.2 mt -65.95 -50.46 64.29 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.8 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.455 ' HE3' ' NH2' ' A' ' 56' ' ' ARG . 0.3 OUTLIER -56.63 -12.15 1.68 Allowed 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.735 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -96.53 -52.32 3.99 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.545 -0.862 . . . . 0.0 111.212 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.421 ' HB3' HH21 ' A' ' 62' ' ' ARG . 26.4 mtp85 -57.43 -171.77 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 119.548 -0.861 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -42.6 -46.14 5.71 Favored Glycine 0 N--CA 1.492 2.37 0 C-N-CA 119.592 -1.289 . . . . 0.0 110.43 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.394 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.379 -179.978 . . . . . . . . 1 1 . 1 stop_ save_