data_2out_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 2out _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.433 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 6.3 t . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.739 0.304 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.451 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.82 152.99 38.59 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -98.88 122.93 42.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.59 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.22 155.63 11.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.007 0.432 . . . . 0.0 111.873 -178.47 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.541 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -135.71 134.91 51.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.113 0.482 . . . . 0.0 111.201 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 14.1 m -102.36 107.52 22.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.039 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.72 106.46 18.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.8 t30 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.371 -179.215 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.872 0.368 . . . . 0.0 111.01 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.541 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.7 t-20 -116.36 130.53 56.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.1 m -86.96 145.14 26.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.455 0.645 . . . . 0.0 111.625 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.626 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.41 142.14 44.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.865 179.717 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.626 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.34 157.56 37.53 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.11 0.481 . . . . 0.0 110.773 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.2 105.15 2.4 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.764 0.792 . . . . 0.0 111.095 -177.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 5.6 t -123.66 166.48 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.047 0 CA-C-N 114.205 -1.362 . . . . 0.0 110.617 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.406 ' O ' ' CZ ' ' A' ' 8' ' ' PHE . 11.3 t -52.09 -73.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.351 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -156.5 -16.69 0.1 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -43.03 -45.88 5.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.879 0.371 . . . . 0.0 111.408 -179.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.624 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -44.24 -60.92 1.69 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.204 179.562 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 46' ' ' LYS . 11.4 tp -52.01 -55.38 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.784 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -35.07 79.08 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 40' ' ' SER . 2.6 tp60 -68.2 -41.8 80.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.852 0.358 . . . . 0.0 111.061 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.412 ' CB ' ' HB ' ' A' ' 53' ' ' VAL . 68.2 mt -78.74 -31.24 46.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.61 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -79.64 -29.8 41.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 110.865 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.53 -29.7 59.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.185 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -93.19 110.15 44.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.764 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.85 58.78 6.62 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.514 2.143 . . . . 0.0 112.418 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -140.97 -45.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.75 175.35 5.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.545 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.9 m -110.67 146.04 16.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.96 0.41 . . . . 0.0 111.984 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.412 ' HB ' ' CB ' ' A' ' 45' ' ' LEU . 3.2 p -130.82 116.32 33.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.818 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.489 ' O ' HG23 ' A' ' 10' ' ' VAL . 3.0 mm-40 -127.47 131.43 50.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.48 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.548 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.8 pt -88.75 132.3 33.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.586 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 39.1 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.489 179.518 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.5 tp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.898 0.38 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -44.09 41.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.556 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.88 -14.87 38.01 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -93.66 104.19 16.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.825 0.345 . . . . 0.0 110.521 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 68.0 m -79.94 -97.61 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.458 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.5 t -142.89 -41.85 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.942 0.401 . . . . 0.0 111.246 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 98' ' ' LYS . 9.8 pt-20 -77.77 -20.88 52.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.618 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -51.01 24.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.221 0.534 . . . . 0.0 109.912 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.603 HD12 HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -50.86 -58.3 6.32 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.904 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' A' ' 95' ' ' GLU . 3.4 ptpt -56.87 -33.31 66.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.727 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.1 -24.15 28.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.982 0.42 . . . . 0.0 112.004 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.466 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 1.3 tp60 -87.09 -37.8 17.08 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.533 ' HG ' ' CE1' ' A' ' 121' ' ' PHE . 1.2 mt -60.07 -46.94 87.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.033 0.444 . . . . 0.0 110.081 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -39.83 90.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.179 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.12 -6.58 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.125 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -101.75 -15.34 17.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.14 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.29 39.2 3.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.58 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 29.6 mt -141.58 85.08 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.762 0.315 . . . . 0.0 111.169 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.6 t -62.08 157.92 17.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.448 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 2.0 p90 -152.39 101.13 2.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.971 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.51 -52.49 2.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.823 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -83.16 -59.1 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.767 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.1 t -88.08 -167.83 2.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.717 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.457 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . 54.65 48.71 19.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.031 0.444 . . . . 0.0 111.087 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.32 -70.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.611 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -157.53 -39.87 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.328 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -21.47 33.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.003 0.43 . . . . 0.0 109.993 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 9.5 mm-40 -85.84 -38.79 17.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.658 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.679 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -78.06 -20.14 52.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.611 -0.435 . . . . 0.0 111.524 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.679 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -28.0 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.779 177.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.58 -31.81 19.66 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.18 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -49.05 -53.11 21.71 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.147 -178.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.533 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 88.5 m-85 . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 111.416 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.684 ' HA ' ' O ' ' A' ' 37' ' ' VAL . 2.0 t . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 120.523 0.202 . . . . 0.0 110.813 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.547 ' CE2' ' HB ' ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.52 145.61 30.22 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.0 p -123.56 121.19 35.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.944 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.679 ' H ' ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.75 152.43 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 111.915 -178.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.6 p -127.43 137.31 58.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.68 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 15.7 m -110.78 104.65 17.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -90.66 106.33 18.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.748 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 121.026 0.441 . . . . 0.0 111.535 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.423 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.893 0.377 . . . . 0.0 111.329 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.488 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 2.3 t-20 -124.06 138.27 54.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.08 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.07 145.05 26.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.361 0.601 . . . . 0.0 111.511 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.681 HD12 ' O ' ' A' ' 35' ' ' ALA . 1.6 tm? -101.29 150.91 22.5 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.643 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.681 ' O ' HD12 ' A' ' 34' ' ' LEU . . . -70.73 156.64 39.25 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 121.742 0.782 . . . . 0.0 112.828 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -71.18 105.02 3.26 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.924 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.684 ' O ' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -123.46 -170.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.955 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 p -85.66 43.01 1.0 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 79.23 -16.51 0.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -44.85 -34.15 2.23 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.125 0.488 . . . . 0.0 110.586 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.565 ' OE1' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -56.99 -44.24 82.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.258 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.9 tp -56.46 -55.63 31.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.147 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -26.18 55.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.557 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -49.4 75.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.821 0.343 . . . . 0.0 110.594 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HB3' ' HB ' ' A' ' 53' ' ' VAL . 11.4 mt -79.06 -46.55 17.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -54.93 -22.56 15.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.346 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.01 -70.77 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.639 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -64.07 117.2 33.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.858 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -80.57 87.27 1.53 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.509 2.14 . . . . 0.0 112.546 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -168.15 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.917 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.87 174.85 6.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.505 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -115.91 106.86 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.279 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.404 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 2.1 p -99.02 115.71 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.54 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -108.77 130.36 55.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.823 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.547 ' HB ' ' CE2' ' A' ' 8' ' ' PHE . 1.3 pp -107.64 105.48 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.721 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.761 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.417 ' CD2' HG12 ' A' ' 118' ' ' ILE . 18.9 tp . . . . . 0 CA--C 1.527 0.087 0 CA-C-O 120.765 0.317 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -49.04 -47.6 44.55 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.532 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.08 -13.06 22.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -94.66 -20.9 19.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 120.644 0.259 . . . . 0.0 111.18 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.6 p 61.13 -147.92 0.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.953 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.694 ' HA ' HD13 ' A' ' 97' ' ' LEU . 21.5 t -120.34 -54.92 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.073 0 CA-C-O 121.012 0.434 . . . . 0.0 111.512 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -65.08 -19.96 66.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.971 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.7 OUTLIER -76.33 -37.88 56.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 120.774 0.321 . . . . 0.0 110.784 -178.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.694 HD13 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -64.04 -58.5 6.49 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.766 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.412 ' HD2' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -54.23 -35.07 62.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.976 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.03 -23.66 28.51 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.43 ' O ' ' N ' ' A' ' 104' ' ' ARG . 6.2 mm-40 -86.78 -39.96 15.44 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.447 HD21 ' CZ ' ' A' ' 121' ' ' PHE . 0.8 OUTLIER -55.94 -48.78 75.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.194 0.521 . . . . 0.0 109.945 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -40.59 96.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.422 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -80.38 -6.35 57.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.433 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' A' ' 100' ' ' GLN . 5.0 ttt180 -97.87 -15.45 20.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.307 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 108.62 15.08 14.15 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.274 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.3 -30.88 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.111 0.456 . . . . 0.0 110.758 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.7 p 47.29 28.54 1.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.614 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.429 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 1.1 m-85 60.62 -174.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.525 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -177.46 173.82 1.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.889 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -31.06 60.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.82 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.32 -29.94 14.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.643 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -80.99 58.82 3.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.06 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -70.69 -66.51 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.404 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 10.4 ptpp? -159.0 -45.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.61 -21.64 59.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.912 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -85.16 -37.52 20.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.997 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.458 ' CD1' HD11 ' A' ' 97' ' ' LEU . 4.0 pp -71.23 -38.03 71.98 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.001 0.429 . . . . 0.0 110.382 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.454 ' N ' ' CD1' ' A' ' 117' ' ' LEU . 1.7 tt -70.03 -26.56 30.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.121 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.92 -33.47 19.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.077 0.465 . . . . 0.0 111.173 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.16 -36.0 82.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.839 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.502 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 5.8 m-85 . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.913 0.387 . . . . 0.0 111.277 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 37' ' ' VAL . 6.4 t . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.867 0.365 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.506 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.87 153.66 39.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.546 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 18.6 p -92.38 124.86 36.74 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.554 HG21 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 154.25 11.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.044 0.449 . . . . 0.0 111.334 -178.591 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.787 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.26 128.56 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 121.095 0.474 . . . . 0.0 112.035 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.407 ' CG1' ' CD1' ' A' ' 45' ' ' LEU . 1.7 m -96.92 104.53 15.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.773 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -107.96 106.58 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.621 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 m120 . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.938 179.924 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 121.186 0.517 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.787 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 t-20 -122.05 127.89 50.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.473 -0.785 . . . . 0.0 108.926 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 p -86.43 145.46 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.718 0.771 . . . . 0.0 112.653 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.613 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -122.09 141.33 51.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.149 179.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.613 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -71.16 155.92 40.18 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.141 0.496 . . . . 0.0 110.923 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.506 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -71.13 109.88 5.47 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.418 0.627 . . . . 0.0 111.838 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.7 OUTLIER -129.13 179.42 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.809 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.427 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 0.6 OUTLIER -51.22 -83.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.303 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.424 ' HA ' ' NE2' ' A' ' 41' ' ' GLN . 3.9 tt0 -148.02 -16.57 0.35 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.52 -47.31 5.1 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.551 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 1.2 pp0? -52.23 -27.69 15.75 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.44 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.3 tp -81.81 -39.8 23.48 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.843 0.354 . . . . 0.0 110.846 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.3 -21.46 33.23 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.422 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -70.5 -49.96 42.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 110.563 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.413 HD13 ' CG1' ' A' ' 10' ' ' VAL . 35.5 mt -78.79 -36.64 42.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.947 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -67.37 -28.57 68.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.863 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.79 -28.3 3.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.228 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -101.97 104.41 35.75 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.761 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.78 66.43 4.86 Favored 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.486 2.124 . . . . 0.0 112.246 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.48 -39.1 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.309 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.83 -167.29 1.37 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.669 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.13 106.75 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.908 0.385 . . . . 0.0 111.883 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.6 p -103.21 111.74 34.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.12 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.27 144.85 50.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.528 -179.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.554 ' HA ' HG21 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -103.9 128.56 57.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.181 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 62.4 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.772 179.938 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 30.7 tp . . . . . 0 N--CA 1.463 0.211 0 CA-C-O 120.695 0.284 . . . . 0.0 111.421 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -49.05 -49.49 41.1 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.801 0.334 . . . . 0.0 111.256 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -13.87 32.61 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.429 ' HB3' ' CD1' ' A' ' 118' ' ' ILE . 2.5 m-85 -79.23 139.31 37.95 Favored 'General case' 0 C--O 1.231 0.127 0 O-C-N 122.196 -0.315 . . . . 0.0 110.604 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.93 -70.21 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.221 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.546 ' HA ' HD13 ' A' ' 97' ' ' LEU . 39.9 t -153.27 -44.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.004 0.431 . . . . 0.0 111.405 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -20.69 38.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.642 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -76.1 -45.01 36.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 -179.334 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.546 HD13 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -59.32 -59.61 5.18 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.396 0.617 . . . . 0.0 110.27 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.448 ' HE3' HD23 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -58.29 -30.74 66.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.02 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.66 -21.4 30.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.598 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.43 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 0.0 OUTLIER -85.0 -37.55 20.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.579 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.541 ' HG ' ' CZ ' ' A' ' 121' ' ' PHE . 5.0 mt -64.57 -45.49 86.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 109.573 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -40.34 96.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.857 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -77.31 -6.73 54.31 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.249 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -102.01 -15.22 16.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.024 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 77.91 61.42 2.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.376 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.436 ' CG2' HD22 ' A' ' 101' ' ' LEU . 6.3 tt -151.66 93.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.785 0.326 . . . . 0.0 111.142 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.01 140.93 6.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.068 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.571 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -121.9 -86.41 0.65 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.779 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 51.84 103.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.802 0.334 . . . . 0.0 111.346 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 64.04 178.22 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.411 . . . . 0.0 111.009 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 2.4 m 56.46 23.01 7.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.037 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . 168.14 75.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.04 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.75 -81.55 0.05 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.731 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.581 ' O ' HG21 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -131.88 -57.47 0.98 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.57 74.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 0.0 110.737 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -86.18 -33.54 20.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.359 0.599 . . . . 0.0 110.369 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 97' ' ' LEU . 7.8 tp -78.09 -21.54 50.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.994 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.581 HG21 ' O ' ' A' ' 114' ' ' LYS . 2.4 tp -82.77 -29.66 8.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.55 -31.02 21.46 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.71 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 tp -49.23 -45.1 44.1 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.07 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.541 ' CZ ' ' HG ' ' A' ' 101' ' ' LEU . 48.8 m-85 . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.368 . . . . 0.0 110.953 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.417 HG22 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.675 0.274 . . . . 0.0 110.659 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.06 145.24 31.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.322 0.582 . . . . 0.0 112.535 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.5 p -92.75 126.52 37.87 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.95 153.59 11.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.459 -178.503 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.495 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.1 p -138.51 126.9 29.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 0.0 111.623 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.45 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 7.7 m -95.74 104.44 15.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.289 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -99.52 106.56 18.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 t30 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.815 -179.687 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.45 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 3.5 p-10 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.919 0.39 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.495 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 13.6 t-20 -122.24 133.83 54.7 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.054 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.6 m -87.1 145.42 26.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 111.63 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.632 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.84 142.18 44.53 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.998 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.632 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.4 157.58 37.53 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.33 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.431 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.23 113.05 6.22 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.688 0.756 . . . . 0.0 111.155 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.417 ' CA ' HG22 ' A' ' 7' ' ' THR . 2.8 t -129.28 171.71 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.708 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.401 ' O ' ' CZ ' ' A' ' 8' ' ' PHE . 42.7 m -56.38 -72.55 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.16 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.5 -16.67 0.11 Allowed 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 p -46.21 -41.09 12.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.518 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.72 -28.56 63.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.416 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 10.6 tp -78.45 -50.59 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.0 110.8 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.53 -22.35 59.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.496 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -66.85 -44.56 80.71 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.934 0.397 . . . . 0.0 110.371 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.432 HD11 HG12 ' A' ' 10' ' ' VAL . 18.0 mt -78.88 -54.08 6.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.379 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 2.5 mttp -45.59 -28.75 1.02 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.469 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.82 -27.51 5.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.305 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.57 94.13 48.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.5 -21.27 18.08 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.733 2.289 . . . . 0.0 112.712 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.412 ' HB3' HD13 ' A' ' 51' ' ' LEU . 9.1 ttm180 -47.65 -39.7 17.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.49 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.412 HD13 ' HB3' ' A' ' 50' ' ' ARG . 0.0 OUTLIER -107.28 -165.22 1.04 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.519 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.59 140.75 48.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.747 0.308 . . . . 0.0 111.514 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.415 ' CG2' ' CD1' ' A' ' 45' ' ' LEU . 3.3 p -132.22 116.81 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.896 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.431 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.5 mt-30 -127.63 133.19 49.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.653 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.462 ' HA ' HG22 ' A' ' 10' ' ' VAL . 1.1 pt -93.93 130.67 42.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.966 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.0 p . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.785 179.861 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.826 0.346 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -48.74 -35.87 15.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.698 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -62.23 -12.59 21.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.403 ' HB3' ' CD2' ' A' ' 97' ' ' LEU . 8.0 m-85 -80.73 -8.04 59.54 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.256 -0.278 . . . . 0.0 111.346 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.87 -162.17 0.19 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.779 0.323 . . . . 0.0 111.079 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.53 ' HA ' ' CD1' ' A' ' 97' ' ' LEU . 21.9 t -115.78 -42.72 3.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.21 0.529 . . . . 0.0 110.947 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -78.21 -19.71 53.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.121 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -27.53 54.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.0 110.675 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.854 HD23 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -76.35 -59.08 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.493 ' HG3' ' CZ ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -47.38 -34.93 7.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.741 177.711 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.94 -21.71 29.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.021 0.439 . . . . 0.0 111.737 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 4.1 mm-40 -86.65 -38.59 16.91 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.566 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.555 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 3.2 mt -59.84 -48.07 83.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.118 0.485 . . . . 0.0 109.964 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -39.03 91.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.48 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -6.57 58.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.3 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.414 ' HB3' ' CD1' ' A' ' 106' ' ' ILE . 2.1 ttt85 -100.12 -15.57 18.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.308 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 98.72 38.9 3.77 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.339 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 104' ' ' ARG . 4.2 mp -110.32 -22.01 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.793 0.296 . . . . 0.0 111.045 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.7 t 45.51 28.34 0.49 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.794 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.493 ' CZ ' ' HG3' ' A' ' 98' ' ' LYS . 90.2 m-85 51.24 -160.23 0.09 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.108 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.8 pttt 45.52 93.13 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.064 0.459 . . . . 0.0 111.322 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 179.0 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.618 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 179.18 42.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.765 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -145.22 147.67 32.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.201 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' THR . . . . . 0.419 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 52.5 p -139.72 -80.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.485 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.4 tttm -145.38 -57.12 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.74 0.305 . . . . 0.0 110.74 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.0 -22.18 33.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.088 0.471 . . . . 0.0 109.884 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -86.2 -38.22 17.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -74.5 -36.82 63.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.181 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.854 ' HA ' HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -62.67 -28.54 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.402 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.27 -33.0 19.41 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.918 0.39 . . . . 0.0 111.559 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.43 -53.02 62.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.563 ' CE2' ' HB3' ' A' ' 97' ' ' LEU . 24.8 m-85 . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 120.939 0.399 . . . . 0.0 111.75 -178.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.476 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 8.0 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.834 0.35 . . . . 0.0 110.586 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.456 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -146.92 148.06 31.4 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.9 m -96.18 115.01 26.76 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.585 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.17 151.39 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-O 120.895 0.378 . . . . 0.0 111.59 -178.711 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.467 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.6 p -137.4 131.7 44.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.538 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 29.3 m -93.06 104.75 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.287 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.53 106.68 17.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.705 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.8 t30 . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.775 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.4 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 34.1 p-10 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.963 0.411 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 2.0 t-20 -113.88 125.08 53.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.061 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.0 145.43 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.434 0.635 . . . . 0.0 111.685 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.585 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -112.09 138.95 48.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.816 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.557 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.45 156.68 39.04 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.279 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.476 ' CB ' ' OG1' ' A' ' 7' ' ' THR . . . -70.46 108.4 4.26 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 111.426 -178.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.6 OUTLIER -128.21 -176.51 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.186 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.449 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 0.1 OUTLIER -48.82 -68.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.472 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.16 -17.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.5 t -42.42 -37.66 1.65 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.793 0.33 . . . . 0.0 111.687 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.577 ' CB ' ' HG ' ' A' ' 34' ' ' LEU . 2.3 pp0? -53.62 -50.46 65.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.456 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.32 -46.47 86.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.091 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.87 -33.09 68.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.301 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -44.31 93.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.943 0.402 . . . . 0.0 110.279 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.43 HD12 ' CG1' ' A' ' 10' ' ' VAL . 21.9 mt -78.74 -33.63 46.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.885 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.4 mttt -71.17 -22.58 62.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.132 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.09 -61.83 1.7 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.574 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.03 124.51 53.94 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.69 56.89 6.24 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.576 2.184 . . . . 0.0 112.418 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.69 -39.36 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.944 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.413 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -111.86 -173.1 2.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.446 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.454 ' O ' ' CG2' ' A' ' 52' ' ' VAL . 16.2 m -119.44 106.26 18.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.835 0.35 . . . . 0.0 111.881 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.5 p -99.87 106.19 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.172 0.51 . . . . 0.0 110.757 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.524 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -127.33 127.89 45.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.107 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.54 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.13 130.35 37.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.05 0.452 . . . . 0.0 111.455 -179.824 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.9 p . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.559 179.656 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 mm? . . . . . 0 CA--C 1.529 0.145 0 CA-C-O 120.54 0.21 . . . . 0.0 111.386 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -48.62 -49.44 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.7 0.286 . . . . 0.0 111.221 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -10.1 10.3 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 3.7 m-85 -104.9 127.45 52.73 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.691 0.281 . . . . 0.0 110.655 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.3 -87.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.06 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.677 ' O ' ' CD2' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -151.83 -37.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-O 120.972 0.415 . . . . 0.0 111.047 179.855 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.63 -19.66 35.05 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.869 0.366 . . . . 0.0 110.99 178.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -77.91 -43.1 31.03 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.246 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.677 ' CD2' ' O ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -64.8 -55.84 17.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.868 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.465 ' CD ' ' O ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -50.89 -31.95 19.08 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.0 178.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.06 -25.26 27.71 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.122 0.487 . . . . 0.0 111.537 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 1.7 mt-30 -86.88 -43.59 12.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.888 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.495 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 8.8 mt -54.74 -46.75 74.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.465 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -39.07 88.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.855 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -15.85 63.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 101' ' ' LEU . 8.7 ptm180 -107.96 -15.23 14.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.047 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.59 83.9 0.47 Allowed Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.826 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.424 HG22 ' CD2' ' A' ' 101' ' ' LEU . 14.6 tt -125.84 -39.46 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.69 0.281 . . . . 0.0 111.524 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.413 ' N ' HG23 ' A' ' 106' ' ' ILE . 4.1 m 71.58 87.8 0.11 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.647 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -116.0 124.89 51.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.997 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -176.98 37.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -170.8 30.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.341 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 84.2 p 178.78 -76.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.749 0.309 . . . . 0.0 110.922 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.08 81.02 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.734 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -72.4 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.364 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.405 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -146.05 -57.44 0.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.491 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.28 67.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 11.8 mm-40 -85.91 -37.1 19.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.886 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -69.15 -40.85 77.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.828 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.538 ' HA ' ' HG ' ' A' ' 97' ' ' LEU . 0.9 OUTLIER -70.6 -30.5 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.47 ' N ' HG13 ' A' ' 118' ' ' ILE . . . -86.16 -31.83 21.6 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.34 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 1.1 mp -54.52 -42.75 71.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.323 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.495 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 1.9 m-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.601 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.494 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 12.5 t . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.962 0.41 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.454 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -146.79 145.28 29.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.24 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.6 p -94.45 133.4 38.08 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.652 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.43 155.86 11.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 121.039 0.447 . . . . 0.0 111.569 -179.093 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.3 p -138.34 101.53 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.596 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.2 t -92.69 129.23 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.161 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.81 107.41 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 120.909 0.385 . . . . 0.0 110.753 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 121.047 0.451 . . . . 0.0 111.411 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.474 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 23.0 t-20 -143.64 123.66 13.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.4 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -86.85 145.58 26.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.398 0.618 . . . . 0.0 111.361 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.652 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -115.37 141.37 48.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.97 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.582 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.32 156.1 39.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.158 0.504 . . . . 0.0 110.555 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.494 ' CB ' ' OG1' ' A' ' 7' ' ' THR . . . -70.56 105.34 3.07 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.496 0.665 . . . . 0.0 111.715 -177.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.475 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.8 OUTLIER -122.31 -175.92 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.909 -179.674 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.414 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 0.2 OUTLIER -59.73 -63.91 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.558 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -173.43 -18.64 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.7 m -42.41 -32.1 0.49 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.991 0.424 . . . . 0.0 111.011 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.646 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.59 -61.64 2.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.548 179.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.471 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 7.3 tp -52.6 -52.83 53.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.71 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.42 -34.88 78.95 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.682 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.09 -52.52 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.909 0.385 . . . . 0.0 110.438 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.43 ' HB3' ' HB ' ' A' ' 53' ' ' VAL . 0.5 OUTLIER -78.71 -54.54 6.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.748 179.516 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -53.47 -24.05 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.304 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.26 -29.94 1.82 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 111.372 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -128.62 125.78 23.2 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 61.28 4.96 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.405 2.07 . . . . 0.0 112.366 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.437 ' HB2' HD23 ' A' ' 51' ' ' LEU . 20.8 mmt-85 -123.91 -39.69 2.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' A' ' 50' ' ' ARG . 0.0 OUTLIER -119.85 133.44 55.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.962 0.41 . . . . 0.0 110.971 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.2 t -68.87 107.21 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.768 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.43 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 2.1 p -103.4 115.26 45.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.938 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -127.07 144.9 50.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.833 -0.622 . . . . 0.0 112.165 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.552 ' HA ' HG22 ' A' ' 10' ' ' VAL . 1.9 pt -102.64 134.39 43.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.176 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.8 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.962 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.866 0.365 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -48.97 -37.18 19.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.495 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 38.3 p -61.98 -15.21 42.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -94.23 133.8 37.37 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.804 0.335 . . . . 0.0 110.675 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 3.0 p -74.45 -94.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.359 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.402 ' HA ' HD13 ' A' ' 97' ' ' LEU . 1.4 m -164.41 -38.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.054 0.454 . . . . 0.0 110.79 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.75 -20.88 38.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.691 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -66.95 -52.23 45.45 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.349 0.595 . . . . 0.0 109.74 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.572 HD11 ' HG ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.92 -59.61 4.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.715 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.452 ' CE ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -44.65 -38.35 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.939 178.431 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.19 -21.92 28.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.048 0.452 . . . . 0.0 111.669 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 6.8 mm-40 -86.37 -47.81 9.02 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.09 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.451 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 5.5 mt -51.89 -48.3 64.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.164 0.506 . . . . 0.0 109.845 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.41 HG23 ' CE1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -62.12 -41.42 98.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.229 179.462 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.74 -6.96 50.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.106 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -105.81 -15.43 14.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 78.5 70.94 1.27 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.94 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 107' ' ' THR . 0.2 OUTLIER -128.26 -159.33 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.469 ' N ' ' CG2' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -140.45 116.11 10.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.838 0.351 . . . . 0.0 110.791 179.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.442 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 2.4 p90 -138.72 105.85 5.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.987 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -176.78 37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.783 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.52 -50.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 91.6 p -101.05 -63.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.432 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -70.61 64.79 0.3 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.07 0.462 . . . . 0.0 110.334 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -61.19 -75.14 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.346 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.468 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 1.5 ptmt -146.3 -57.46 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.718 0.294 . . . . 0.0 111.434 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.24 -23.01 64.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.863 0.363 . . . . 0.0 111.115 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.4 mm-40 -85.82 -36.29 20.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.855 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.572 ' HG ' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -74.48 -37.11 63.28 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.597 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.546 HG23 HD11 ' A' ' 97' ' ' LEU . 1.7 pp -64.72 -35.19 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.579 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.33 -28.26 23.79 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.891 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.01 -30.6 71.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.687 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.488 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 120.721 0.296 . . . . 0.0 111.151 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.412 HG23 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.637 0.256 . . . . 0.0 110.793 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.489 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.22 144.09 30.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.43 0.633 . . . . 0.0 112.393 -179.522 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.4 p -95.1 121.83 37.14 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.81 151.53 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 111.355 -178.775 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.54 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.9 p -134.17 123.5 43.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.242 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.469 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 1.8 m -95.65 104.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.784 -179.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.43 106.89 19.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.896 178.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 . . . . . 0 C--N 1.329 -0.297 0 CA-C-O 121.24 0.543 . . . . 0.0 111.61 -179.2 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.469 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 2.2 p30 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.679 0.276 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.54 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.2 t30 -116.74 131.94 56.82 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.291 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.02 145.54 26.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.536 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.61 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -113.75 140.61 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.19 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.59 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.29 157.5 37.59 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.202 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.431 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.4 112.74 6.14 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.734 0.778 . . . . 0.0 111.2 -177.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.412 ' CA ' HG23 ' A' ' 7' ' ' THR . 3.5 t -128.35 168.82 20.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 CA-C-N 114.463 -1.244 . . . . 0.0 110.584 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.2 m -55.3 -61.25 2.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.273 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -164.91 -16.76 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.0 p -43.62 -33.67 1.25 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.501 ' CD ' ' N ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -65.79 -37.43 86.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.799 0.333 . . . . 0.0 111.749 -179.61 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.501 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.2 tp -68.31 -38.75 81.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.86 -28.99 22.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.276 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -47.93 81.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.874 0.369 . . . . 0.0 110.378 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.478 ' HB3' ' HB ' ' A' ' 53' ' ' VAL . 1.9 mp -79.02 -41.53 28.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -73.27 -12.74 60.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.299 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -50.81 -33.29 22.92 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.822 0.344 . . . . 0.0 111.295 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 p-10 -121.66 129.83 25.03 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.83 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -77.09 70.82 6.52 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.5 2.134 . . . . 0.0 112.272 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -131.8 -56.01 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.886 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.506 ' N ' ' CD1' ' A' ' 51' ' ' LEU . 2.8 mp -100.51 170.46 8.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.628 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.9 t -105.58 107.39 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.608 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.478 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 1.5 p -101.18 114.57 40.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.29 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.535 ' O ' HG21 ' A' ' 10' ' ' VAL . 0.8 OUTLIER -127.12 125.93 42.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.454 -179.232 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.515 ' HA ' HG21 ' A' ' 10' ' ' VAL . 2.6 pp -88.19 145.79 7.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.289 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 44.3 p . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.644 179.694 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.5 tp . . . . . 0 N--CA 1.462 0.143 0 CA-C-O 120.644 0.259 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.8 m-20 -48.78 -45.63 40.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.428 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.3 p -62.09 -14.55 37.63 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -84.09 143.82 29.46 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.684 0.278 . . . . 0.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 69.9 p -110.63 -88.23 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.588 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.6 t -154.56 -43.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -80.3 -20.84 43.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.081 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.1 -49.58 42.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 0.0 110.19 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.572 ' HA ' ' CE2' ' A' ' 121' ' ' PHE . 0.0 OUTLIER -56.02 -58.56 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.528 179.557 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -55.63 -34.67 65.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.087 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.02 -21.64 29.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.056 0.455 . . . . 0.0 111.573 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.466 ' N ' ' O ' ' A' ' 96' ' ' GLN . 3.5 mm-40 -86.53 -41.09 14.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.302 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.555 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 12.9 mt -56.14 -49.91 72.61 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.315 0.579 . . . . 0.0 109.754 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.11 -38.96 92.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.324 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.65 -6.84 53.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.957 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.3 mtt180 -100.36 -15.32 18.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.858 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.96 47.58 4.97 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.838 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.2 tt -140.43 95.91 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.822 0.344 . . . . 0.0 111.064 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.03 122.94 9.33 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.951 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.41 ' HB2' ' CB ' ' A' ' 112' ' ' ALA . 13.7 p90 -121.56 28.02 7.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.131 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -29.34 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.852 0.358 . . . . 0.0 110.77 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -124.98 150.97 46.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.855 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.15 26.34 13.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.41 ' CB ' ' HB2' ' A' ' 108' ' ' PHE . . . -148.53 103.99 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.18 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.3 p -98.92 -79.38 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.725 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.67 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 20.4 tttt -158.4 -39.5 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.087 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.7 -20.44 33.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.028 0.442 . . . . 0.0 110.224 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -85.59 -39.08 17.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.756 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.67 ' CD2' ' HA ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -78.31 -19.55 53.31 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.153 -179.771 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.639 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -80.79 -28.39 11.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 120.566 -0.453 . . . . 0.0 109.974 178.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.09 -33.12 19.59 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.133 0.492 . . . . 0.0 111.106 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.18 -42.76 70.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.269 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 30.7 m-85 . . . . . 0 C--N 1.329 -0.314 0 CA-C-O 120.917 0.389 . . . . 0.0 111.305 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.426 HG21 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.686 0.279 . . . . 0.0 110.821 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.501 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.17 143.81 30.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.434 0.635 . . . . 0.0 112.632 -179.659 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 24.4 p -95.55 121.4 37.2 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.598 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.73 150.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.003 0.43 . . . . 0.0 111.282 -178.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.4 p -134.06 120.58 35.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.259 0.552 . . . . 0.0 111.522 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.442 ' O ' HG21 ' A' ' 12' ' ' VAL . 11.5 m -94.17 104.53 15.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.382 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -98.63 105.28 17.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.419 . . . . 0.0 110.15 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.466 ' ND2' ' HA ' ' A' ' 51' ' ' LEU . 13.1 m120 . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.065 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.758 0.314 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.422 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 17.9 t30 -129.94 131.04 45.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.943 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.14 145.48 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.302 0.572 . . . . 0.0 111.121 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -111.72 140.46 46.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.26 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.572 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.26 157.63 37.35 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.11 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.436 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.6 112.13 5.88 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.685 0.755 . . . . 0.0 111.287 -177.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.426 ' CA ' HG21 ' A' ' 7' ' ' THR . 4.1 t -127.77 168.26 21.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.088 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.656 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.7 t -55.09 -58.85 5.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.397 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -167.91 -17.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.5 m -43.43 -33.25 1.03 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.549 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -66.52 -41.45 88.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.829 0.347 . . . . 0.0 111.837 -179.551 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.478 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 4.8 tp -66.77 -34.36 77.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.501 -178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -91.94 -30.71 15.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.632 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.31 -42.42 88.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.947 0.403 . . . . 0.0 110.41 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.434 ' CD1' HG13 ' A' ' 12' ' ' VAL . 63.0 mt -79.04 -47.22 16.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.925 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -17.82 47.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.438 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.13 -39.87 6.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.801 0.334 . . . . 0.0 111.65 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.1 121.56 58.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -84.17 49.42 2.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.677 2.252 . . . . 0.0 112.774 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.23 -38.1 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.272 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.466 ' HA ' ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -93.55 -165.59 1.36 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.426 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.3 m -132.56 133.0 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 45' ' ' LEU . 1.6 p -131.83 112.83 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.021 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.544 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.4 OUTLIER -127.66 126.21 41.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.837 -178.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.503 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.4 pp -88.11 126.66 41.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.042 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.1 p . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 179.88 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.586 0.231 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -49.07 -50.12 38.27 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.726 0.298 . . . . 0.0 111.132 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -13.05 25.9 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -94.84 122.82 37.86 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.643 0.259 . . . . 0.0 110.6 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.9 p -117.98 -95.49 0.48 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.349 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.58 ' HA ' HD21 ' A' ' 97' ' ' LEU . 3.4 m -138.2 -34.87 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.89 0.376 . . . . 0.0 111.438 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -82.78 -20.41 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.283 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -38.22 21.98 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.58 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -76.3 -49.21 17.56 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.024 -0.671 . . . . 0.0 109.717 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.46 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.9 OUTLIER -56.44 -33.75 66.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.696 178.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.18 -25.76 27.21 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 111.973 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 3.5 mt-30 -86.68 -42.82 13.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.014 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.442 ' HB3' HG21 ' A' ' 106' ' ' ILE . 6.6 mt -54.48 -48.1 72.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.087 0.47 . . . . 0.0 110.385 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -39.64 92.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.062 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -6.85 52.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -106.17 -15.22 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.047 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.89 68.4 1.56 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.774 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.501 ' CG1' ' H ' ' A' ' 107' ' ' THR . 0.4 OUTLIER -119.28 -146.74 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.501 ' H ' ' CG1' ' A' ' 106' ' ' ILE . 4.8 t -150.78 105.11 3.24 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 122.169 -0.332 . . . . 0.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.402 ' CG ' ' O ' ' A' ' 108' ' ' PHE . 2.8 p90 -142.92 66.28 1.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.948 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.35 -31.14 7.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.48 62.11 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.045 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 179.35 -38.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.024 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.49 108.31 17.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.017 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.75 -74.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.308 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.504 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.2 OUTLIER -144.83 -43.89 0.24 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -78.78 -24.31 44.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.929 0.395 . . . . 0.0 110.569 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -85.94 -36.5 19.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.563 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.525 HD22 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -80.04 -19.71 46.97 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.204 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.527 ' HA ' ' HG ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -83.73 -27.01 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.99 -34.55 19.22 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.764 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.5 tp -51.57 -44.4 62.73 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.472 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.447 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 4.9 m-85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.468 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 5.6 t . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.82 0.343 . . . . 0.0 110.761 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.53 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.08 152.25 38.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.098 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 2.6 m -92.4 124.96 36.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.654 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -110.12 151.18 12.41 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 111.659 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -138.01 132.9 43.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.368 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 28.0 m -101.97 104.71 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.795 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.419 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -101.34 106.59 17.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.006 179.01 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.253 0.549 . . . . 0.0 111.671 -179.265 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.419 ' HB3' ' CG ' ' A' ' 13' ' ' GLN . 3.5 p-10 . . . . . 0 N--CA 1.456 -0.129 0 CA-C-O 121.038 0.447 . . . . 0.0 111.265 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.418 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 16.2 m-20 -126.71 127.53 45.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.956 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.7 m -86.96 145.32 26.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.422 0.63 . . . . 0.0 111.739 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.654 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.7 OUTLIER -111.51 138.22 48.32 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.698 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.542 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.48 156.41 39.41 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.923 0.392 . . . . 0.0 110.192 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -70.72 109.96 5.24 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.431 0.634 . . . . 0.0 111.723 -177.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.6 OUTLIER -128.78 -177.01 1.74 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.039 -179.654 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.434 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 1.7 t -51.13 -64.85 0.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.366 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -177.75 -16.59 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.25 -34.47 0.78 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.574 ' CB ' ' HG ' ' A' ' 34' ' ' LEU . 1.4 pp0? -57.25 -49.87 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 0.0 111.232 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -56.14 -53.66 54.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.088 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.19 -27.0 64.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.216 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -64.5 -51.85 60.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.86 0.362 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.427 ' CB ' ' HB ' ' A' ' 53' ' ' VAL . 3.2 mm? -78.51 -32.18 47.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.088 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -75.11 -29.6 60.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.156 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.12 -62.84 1.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.6 120.43 81.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.83 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.41 59.91 6.85 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.514 2.142 . . . . 0.0 112.41 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -115.91 -64.54 1.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.982 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.99 -176.82 3.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.566 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.1 m -103.55 146.37 11.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.774 0.321 . . . . 0.0 111.782 -179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.427 ' HB ' ' CB ' ' A' ' 45' ' ' LEU . 4.8 p -126.66 116.72 45.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.805 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -127.41 139.54 52.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.336 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.521 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -95.11 117.66 39.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.36 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.5 p . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.68 179.817 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.411 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 3.1 mm? . . . . . 0 C--O 1.23 0.027 0 CA-C-O 120.853 0.359 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -48.93 -43.65 39.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.633 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.0 m -61.99 -14.19 32.88 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.533 ' CD1' ' CE2' ' A' ' 121' ' ' PHE . 24.0 m-85 -114.13 104.8 12.48 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.819 0.343 . . . . 0.0 110.644 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.48 -86.58 0.12 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.164 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.581 ' HA ' HD21 ' A' ' 97' ' ' LEU . 11.3 t -148.25 -56.61 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.775 0.321 . . . . 0.0 111.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.44 -20.18 61.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.963 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -20.88 42.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.124 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.64 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -78.4 -58.56 3.19 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.401 -179.619 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.432 ' HB2' ' CZ ' ' A' ' 108' ' ' PHE . 2.3 ptpt -62.14 -25.68 67.88 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.274 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.76 -29.55 25.38 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.021 0.438 . . . . 0.0 112.164 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 29.0 mt-30 -86.72 -29.4 22.43 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.738 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.41 ' CD2' ' HB ' ' A' ' 106' ' ' ILE . 6.0 mt -67.05 -46.29 74.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.22 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.988 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.97 -6.81 49.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.087 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.3 mtt-85 -106.44 -15.3 14.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.957 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.93 64.45 1.42 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.841 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.41 ' HB ' ' CD2' ' A' ' 101' ' ' LEU . 18.1 mt -151.16 100.49 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.66 0.267 . . . . 0.0 111.167 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -57.18 122.25 12.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.84 0.352 . . . . 0.0 110.921 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 98' ' ' LYS . 13.8 p90 -130.56 5.54 4.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.547 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -99.14 31.48 3.03 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 0.0 110.91 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.38 25.97 0.6 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.5 p 177.19 -37.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.914 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -82.99 175.89 9.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.3 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 25.0 p -150.55 -80.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.496 ' HA ' HD23 ' A' ' 117' ' ' LEU . 2.5 pttt -145.35 -46.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.458 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.59 -25.2 41.6 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 0.0 110.264 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.14 -36.73 19.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.401 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.63 HD21 HD23 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.7 -19.42 48.96 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.054 -179.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.624 ' HB ' HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -83.74 -30.18 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 120.874 0.369 . . . . 0.0 110.268 178.502 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.83 -32.38 19.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.286 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.508 ' O ' ' C ' ' A' ' 121' ' ' PHE . 1.5 pp -72.5 -17.11 61.77 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.612 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.48 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 9.5 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.843 0.354 . . . . 0.0 110.647 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.07 146.03 29.85 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.4 m -94.63 115.86 28.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.58 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.27 151.74 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.131 0.491 . . . . 0.0 112.061 -178.312 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.552 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.3 p -138.08 128.2 35.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.151 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 23.4 m -96.78 104.81 16.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.921 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.94 106.53 18.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.024 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 121.089 0.471 . . . . 0.0 112.185 -179.189 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.411 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 121.005 0.431 . . . . 0.0 111.114 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.0 t30 -107.1 122.0 45.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.871 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.1 p -86.7 145.45 26.68 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.538 0.685 . . . . 0.0 111.544 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.596 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -117.2 139.12 51.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.25 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.596 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.85 156.93 38.96 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 120.825 0.345 . . . . 0.0 110.102 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.48 ' CB ' ' OG1' ' A' ' 7' ' ' THR . . . -70.23 107.07 3.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.474 0.654 . . . . 0.0 111.544 -177.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.466 ' CG2' ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -124.66 -175.91 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.296 -179.401 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.466 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 16.4 m -51.68 -68.02 0.2 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.528 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -176.1 -21.43 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.4 -35.23 0.97 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.882 0.372 . . . . 0.0 111.478 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.561 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.22 -39.03 69.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.52 179.81 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.439 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 6.1 tp -70.58 -39.67 73.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.775 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.47 -27.37 56.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.53 -45.02 66.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.009 0.433 . . . . 0.0 110.491 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.417 HD13 ' CG1' ' A' ' 10' ' ' VAL . 51.4 mt -78.7 -30.6 46.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.014 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -69.84 -19.65 63.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.224 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.14 -55.01 27.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.38 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.41 118.65 64.38 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.999 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -81.85 54.7 5.17 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.632 2.221 . . . . 0.0 112.394 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -149.14 -63.28 0.23 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.719 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.66 175.93 0.99 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.489 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.4 m -120.55 123.06 69.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.0 p -116.9 106.28 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 0.0 110.299 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.569 ' O ' HG22 ' A' ' 10' ' ' VAL . 5.0 mt-30 -127.48 131.21 50.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.021 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.533 ' HA ' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.07 119.24 35.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.264 0.554 . . . . 0.0 111.622 -179.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 p . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.466 179.779 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.464 0.272 0 CA-C-O 120.695 0.283 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -48.86 -47.34 42.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.475 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.9 p -62.14 -12.78 21.52 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -115.46 122.43 45.73 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.674 0.273 . . . . 0.0 110.435 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.427 ' N ' HD13 ' A' ' 97' ' ' LEU . 93.5 m -84.75 -98.69 0.06 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.48 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.765 ' HA ' HD22 ' A' ' 97' ' ' LEU . 43.3 t -142.31 -56.84 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.075 0 CA-C-O 120.816 0.341 . . . . 0.0 111.361 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.25 -20.13 61.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.819 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.52 -21.18 38.76 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.083 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.765 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -75.35 -58.74 3.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.357 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.8 ptpt -57.82 -26.9 62.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.95 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.09 29.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.044 0.45 . . . . 0.0 111.663 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -86.79 -38.28 17.02 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 22.8 mt -63.83 -42.64 97.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.662 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.7 p -65.73 -40.82 92.56 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.113 0.482 . . . . 0.0 109.907 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -6.91 50.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.348 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 36.6 mtt180 -106.03 -15.27 14.94 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.158 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.35 42.25 5.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.598 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 23.4 mm -128.41 92.27 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.714 0.293 . . . . 0.0 111.201 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 p -57.75 151.13 18.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.847 0.356 . . . . 0.0 110.864 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.449 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 2.3 p90 -153.5 36.66 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.017 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -45.41 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -134.72 24.47 3.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.005 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 -33.58 4.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.993 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.402 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -139.67 119.64 13.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.142 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 68.6 p -92.21 -73.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.158 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.561 ' HA ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -145.25 -40.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -24.05 32.77 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.5 mm-40 -86.08 -38.46 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.434 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.564 HD21 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -76.25 -19.91 57.9 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.587 -0.278 . . . . 0.0 111.213 -179.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.564 ' N ' HD21 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.6 -33.17 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.249 -0.58 . . . . 0.0 109.582 177.927 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.43 -28.28 22.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 18.5 tp -48.77 -43.79 38.17 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.252 -179.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.527 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 9.2 m-85 . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.535 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.514 0.197 . . . . 0.0 110.695 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.517 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.81 145.68 31.76 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.8 p -94.12 133.15 37.92 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.586 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.98 148.3 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.522 0.677 . . . . 0.0 111.85 -178.935 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.9 p -138.15 101.18 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.958 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.414 HG21 ' CD1' ' A' ' 45' ' ' LEU . 78.9 t -92.6 136.71 24.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.196 -178.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -119.3 112.45 19.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.572 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.05 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.858 0.361 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.4 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.4 p-10 -124.75 133.12 53.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.21 145.61 26.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.069 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.606 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -113.33 143.07 45.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.191 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.606 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.62 156.72 39.09 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-O 121.091 0.472 . . . . 0.0 110.402 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -70.24 115.64 9.67 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.415 0.626 . . . . 0.0 111.551 -177.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.9 OUTLIER -129.72 -173.24 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.958 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.41 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 1.7 t -65.35 -59.19 4.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.552 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -171.2 -16.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.1 m -42.23 -40.82 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HB3' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.37 -43.04 83.2 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.216 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.503 ' N ' HE21 ' A' ' 41' ' ' GLN . 19.7 tp -64.52 -55.36 21.11 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.194 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.99 -23.14 62.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.537 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.25 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.861 0.362 . . . . 0.0 110.276 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.414 ' CD1' HG21 ' A' ' 12' ' ' VAL . 0.8 OUTLIER -78.93 -57.47 3.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.931 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.404 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -51.85 -23.27 4.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.609 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -43.37 -31.43 0.67 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.781 0.324 . . . . 0.0 111.498 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.04 128.01 24.59 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.683 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.95 77.42 2.73 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.426 2.084 . . . . 0.0 112.22 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.426 ' HB3' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -146.54 -45.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.184 -179.846 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -110.61 124.8 52.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.974 0.416 . . . . 0.0 110.827 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.401 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.0 t -64.7 106.06 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.625 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.404 HG11 ' HB2' ' A' ' 46' ' ' LYS . 2.9 p -99.03 123.97 51.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.147 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.406 ' O ' ' CG2' ' A' ' 10' ' ' VAL . 19.8 pt20 -127.0 141.09 51.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.081 -178.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.529 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -100.58 112.7 34.15 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.039 179.539 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.3 t . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.848 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.3 mm? . . . . . 0 N--CA 1.466 0.348 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -48.44 -45.02 35.91 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.565 0.221 . . . . 0.0 111.288 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 p -62.11 -13.21 24.48 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -90.07 115.61 27.47 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.681 0.277 . . . . 0.0 110.427 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 90.4 m -91.22 -107.46 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.778 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.697 ' O ' HD21 ' A' ' 97' ' ' LEU . 10.0 m -135.61 -32.02 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.25 0 CA-C-O 120.916 0.389 . . . . 0.0 111.494 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -83.58 -20.0 34.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.736 0.303 . . . . 0.0 111.068 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -81.53 -32.61 32.21 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' O ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -77.87 -50.03 13.07 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -179.788 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.42 ' CE ' ' O ' ' A' ' 94' ' ' VAL . 3.3 ptpt -62.24 -28.11 69.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.86 -30.39 24.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.963 0.411 . . . . 0.0 111.98 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -86.82 -27.9 23.24 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.597 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 6.5 mt -64.73 -47.23 79.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.261 0.553 . . . . 0.0 109.742 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -34.83 74.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.749 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.28 -12.57 61.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.314 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 101' ' ' LEU . 9.6 ptm180 -110.89 -15.26 13.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.052 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.05 82.72 0.79 Allowed Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.791 -0.718 . . . . 0.0 113.16 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.439 HG22 ' CD2' ' A' ' 101' ' ' LEU . 8.4 tp -126.74 -40.83 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.698 0.285 . . . . 0.0 111.376 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.416 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.2 OUTLIER 73.65 90.83 0.09 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.846 0.355 . . . . 0.0 110.624 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.1 p90 -115.26 139.03 50.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.114 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -43.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.788 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -128.22 27.41 5.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.67 30.27 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.97 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.488 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -178.46 59.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.015 0.436 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.79 -83.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.496 ' HA ' HD21 ' A' ' 117' ' ' LEU . 4.3 ptpt -139.62 -43.79 0.44 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.812 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.86 -24.5 41.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.998 0.428 . . . . 0.0 110.253 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -86.19 -36.55 19.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.837 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.515 HD22 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.97 -21.57 50.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.375 -179.145 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.515 ' N ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.12 -27.54 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.148 177.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.21 -34.17 19.09 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.143 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -49.33 -46.26 46.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.871 -179.003 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.597 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 53.0 m-85 . . . . . 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.399 . . . . 0.0 111.348 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.4 HG22 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.756 0.312 . . . . 0.0 110.598 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.472 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.15 146.46 31.79 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.523 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.3 p -96.9 119.81 36.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.588 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.76 151.55 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.176 0.513 . . . . 0.0 111.633 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.547 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -134.94 126.27 46.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.086 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 9.0 m -95.86 104.77 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.341 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -88.82 106.56 18.46 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-O 121.447 0.641 . . . . 0.0 111.946 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.457 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 36.4 p-10 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.908 0.385 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.547 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.8 t-20 -122.01 136.46 54.92 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.083 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.02 145.2 26.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.492 0.663 . . . . 0.0 111.715 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.7 OUTLIER -111.97 141.44 45.63 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.885 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.579 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.39 157.58 37.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.393 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.435 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.5 112.02 5.73 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.622 0.725 . . . . 0.0 111.243 -177.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.4 ' CA ' HG22 ' A' ' 7' ' ' THR . 5.3 t -127.84 168.62 20.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.64 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.4 t -54.36 -62.07 1.9 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.525 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -164.92 -16.61 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.42 -45.27 4.31 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.502 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -53.4 -47.04 69.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.801 0.334 . . . . 0.0 111.693 -179.619 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.437 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 8.7 tp -57.89 -46.56 84.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.518 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.18 -28.44 48.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.661 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -50.69 67.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.938 0.399 . . . . 0.0 110.712 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.454 HD11 ' CG1' ' A' ' 10' ' ' VAL . 32.4 mt -79.0 -34.3 44.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.414 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -77.7 -10.27 59.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.322 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.47 -45.54 73.19 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.717 0.294 . . . . 0.0 111.261 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -93.28 127.95 44.7 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -79.31 85.79 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.518 2.145 . . . . 0.0 112.565 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -167.13 -72.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.855 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.47 171.03 3.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.609 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.5 t -115.35 106.75 21.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.927 0.394 . . . . 0.0 111.908 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.409 HG23 ' HB2' ' A' ' 45' ' ' LEU . 1.3 p -104.02 111.19 32.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.05 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.505 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.3 mm-40 -127.17 133.54 50.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.523 -179.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.514 ' HA ' HG22 ' A' ' 10' ' ' VAL . 2.6 pp -88.31 133.37 30.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.119 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.3 p . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.792 -179.927 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.427 ' HA ' ' CD1' ' A' ' 92' ' ' PHE . 8.7 tp . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.594 0.235 . . . . 0.0 111.294 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -49.17 -50.25 38.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.655 0.265 . . . . 0.0 111.125 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.22 -10.18 14.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.427 ' CD1' ' HA ' ' A' ' 89' ' ' LEU . 4.4 m-85 -88.29 120.92 30.11 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.6 0.238 . . . . 0.0 110.528 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.8 -91.48 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.536 ' HA ' HD21 ' A' ' 97' ' ' LEU . 20.4 t -131.39 -44.58 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 121.027 0.441 . . . . 0.0 111.65 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -82.29 -19.99 38.39 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -85.72 -29.29 24.04 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.567 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.59 -55.24 4.23 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.453 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.545 ' HE2' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -55.13 -32.83 62.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.794 178.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.36 -24.85 27.42 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.989 0.423 . . . . 0.0 112.086 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 121' ' ' PHE . 71.5 mt-30 -86.57 -45.29 11.2 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.923 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.435 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 4.7 mt -50.89 -49.05 60.16 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.994 0.426 . . . . 0.0 110.38 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -38.27 86.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.113 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -77.17 -6.69 53.92 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.333 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -104.07 -15.18 15.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.215 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.98 47.02 4.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.549 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.7 mm -133.38 91.21 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 0.0 111.078 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 27.3 p -54.64 119.82 5.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.953 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 108' ' ' PHE . 14.6 p90 -117.5 74.24 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.873 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.29 39.81 2.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.759 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -121.49 -47.03 2.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.013 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.16 33.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.039 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -116.66 90.1 3.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.987 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.84 -76.67 0.15 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.04 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.512 ' HA ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -147.21 -39.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -77.57 -22.12 51.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 110.658 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 12.7 mm-40 -85.58 -37.96 18.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.85 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.557 HD21 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -82.37 -19.89 38.28 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.302 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.557 ' N ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.64 -25.24 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.589 177.749 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.72 -35.38 19.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.392 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -33.51 74.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.435 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.258 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.486 HG23 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.524 0.202 . . . . 0.0 110.467 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.461 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.9 135.29 24.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.675 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -89.74 119.98 30.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.617 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.88 156.0 10.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.905 0.383 . . . . 0.0 111.759 -177.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.22 117.48 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.069 0.461 . . . . 0.0 110.718 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 27.1 m -93.14 110.37 23.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.166 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -91.86 111.54 23.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.301 0.572 . . . . 0.0 111.595 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.443 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 22.8 p-10 . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.841 0.353 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.414 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 0.9 OUTLIER -125.0 135.48 52.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.411 179.795 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.5 m -87.11 145.5 26.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.343 0.592 . . . . 0.0 111.069 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.617 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -114.26 140.2 48.78 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.981 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.576 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.17 157.55 37.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.005 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.471 ' CB ' ' HB ' ' A' ' 7' ' ' THR . . . -69.38 106.43 2.93 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.769 0.795 . . . . 0.0 111.168 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.486 ' CA ' HG23 ' A' ' 7' ' ' THR . 5.0 t -124.53 167.61 18.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 114.36 -1.291 . . . . 0.0 110.705 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.51 -64.95 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.433 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -160.25 -16.37 0.05 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.6 m -42.19 -38.14 1.65 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.554 ' CB ' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -63.22 -53.38 54.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.911 0.386 . . . . 0.0 111.309 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.423 ' N ' ' NE2' ' A' ' 41' ' ' GLN . 5.0 tp -57.78 -28.31 63.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.511 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -90.41 -40.47 12.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.683 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.6 tm0? -62.21 -40.73 97.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.808 0.337 . . . . 0.0 110.756 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.465 ' CD1' HG13 ' A' ' 10' ' ' VAL . 7.3 mt -78.84 -39.83 34.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.257 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -65.98 -12.89 58.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.537 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.46 -28.84 2.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.681 0.277 . . . . 0.0 111.504 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -129.48 110.02 17.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.13 -22.66 11.32 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.655 2.237 . . . . 0.0 112.654 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -45.79 -63.7 0.91 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.879 0.371 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.02 170.4 16.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.8 t -119.44 108.28 23.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.884 0.373 . . . . 0.0 111.679 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.408 ' CB ' ' HB2' ' A' ' 45' ' ' LEU . 1.5 p -105.89 111.32 34.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.494 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.496 ' O ' HG21 ' A' ' 10' ' ' VAL . 16.0 mt-30 -127.52 130.9 49.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.583 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.501 ' HA ' HG21 ' A' ' 10' ' ' VAL . 2.6 pp -88.13 145.35 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.064 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.1 p . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.684 179.723 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.0 tp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.696 0.284 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -49.05 -47.2 45.01 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.437 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.5 p -62.33 -9.31 7.74 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.407 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 4.7 m-85 -100.16 137.27 38.83 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.602 0.239 . . . . 0.0 110.504 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -123.17 -96.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.708 -0.223 . . . . 0.0 111.555 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.619 ' HA ' HD23 ' A' ' 97' ' ' LEU . 4.2 m -142.97 -34.03 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -83.27 -20.47 34.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.257 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.414 ' O ' ' CB ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -83.34 -38.19 22.39 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.619 HD23 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -73.3 -46.28 50.51 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.355 -179.392 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.409 ' HE3' ' HB2' ' A' ' 98' ' ' LYS . 3.1 ttmt -60.86 -37.29 81.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.885 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.28 -24.22 27.82 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 61.6 tt0 -86.82 -43.7 12.29 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.202 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 117' ' ' LEU . 2.8 mt -55.7 -47.48 76.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.151 0.501 . . . . 0.0 110.121 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -42.06 98.25 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.246 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -8.15 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.041 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.72 -15.32 18.54 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.9 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.75 51.36 2.88 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.972 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.452 ' CG2' HD23 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -133.43 88.6 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.925 0.393 . . . . 0.0 111.022 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 156.27 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.091 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.477 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -142.76 -105.74 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.829 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.11 33.05 1.01 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.735 0.302 . . . . 0.0 111.556 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.86 -35.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.238 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 11.2 t -111.82 -32.17 6.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.08 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -114.09 119.81 38.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.903 0.382 . . . . 0.0 111.262 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -112.9 -55.58 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.606 ' HA ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -166.25 -39.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.629 179.549 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.11 -22.27 33.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.939 0.399 . . . . 0.0 110.632 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -85.96 -38.11 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.54 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -80.65 -21.18 41.64 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.342 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.561 ' N ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -84.52 -28.36 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.933 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.03 -34.1 19.32 Favored 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.385 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.0 mp -55.4 -34.1 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.402 -179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.534 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 8.8 m-85 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.73 -179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.569 ' HA ' ' O ' ' A' ' 37' ' ' VAL . 13.6 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.048 0.451 . . . . 0.0 110.732 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.532 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.58 146.79 29.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.323 -179.575 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -89.04 124.65 34.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.632 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -110.37 153.6 12.1 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-O 121.322 0.582 . . . . 0.0 112.255 -178.06 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.2 p -138.68 123.73 22.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.197 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 35.6 m -93.37 108.87 21.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.966 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -90.0 106.52 18.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.104 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 2.7 p30 . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 m-80 -122.41 145.75 47.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.052 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.31 145.31 26.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.469 0.652 . . . . 0.0 111.906 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.632 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -114.28 139.41 49.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.641 179.526 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.622 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -71.28 155.26 40.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.089 0.471 . . . . 0.0 110.612 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -71.23 114.37 9.23 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.327 0.584 . . . . 0.0 112.013 -178.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.8 OUTLIER -126.09 -171.66 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.232 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.422 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 2.0 m -89.97 57.59 3.87 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 78.51 -16.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -21.51 4.39 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.523 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -79.96 -28.3 39.61 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.088 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 tp -83.51 -31.78 26.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.018 0.437 . . . . 0.0 110.901 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.66 -29.07 22.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.02 -40.35 82.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.121 0.486 . . . . 0.0 109.986 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.453 ' CB ' ' HB ' ' A' ' 53' ' ' VAL . 49.0 mt -78.82 -39.58 35.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.782 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -28.04 67.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.031 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.32 -29.88 25.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.337 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.82 118.15 47.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.784 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -85.35 42.67 1.11 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.764 2.309 . . . . 0.0 112.765 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mtp85 -119.79 -38.78 2.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.741 0.305 . . . . 0.0 110.625 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.46 -179.11 3.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.179 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 4.7 m -117.99 137.4 52.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.695 0.283 . . . . 0.0 111.626 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.453 ' HB ' ' CB ' ' A' ' 45' ' ' LEU . 4.0 p -125.96 113.1 32.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.094 0.474 . . . . 0.0 110.962 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.443 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.8 mt-30 -127.66 135.57 50.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.325 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.54 ' HA ' HG22 ' A' ' 10' ' ' VAL . 1.5 pp -88.56 113.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.491 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.674 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 tp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.797 0.332 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -48.95 -42.77 38.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.464 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 35.3 m -61.89 -15.7 44.8 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -94.16 91.12 6.63 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 120.889 0.376 . . . . 0.0 110.227 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.3 p -65.09 -105.41 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.748 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.74 ' HA ' HD21 ' A' ' 97' ' ' LEU . 16.1 t -132.56 -56.48 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.876 0.369 . . . . 0.0 111.601 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.42 -19.78 66.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.113 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.17 -21.44 36.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.214 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.74 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -74.39 -58.68 3.14 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.413 ' HB2' ' CZ ' ' A' ' 108' ' ' PHE . 2.3 ptpt -59.75 -29.83 68.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.667 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.53 -25.71 28.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.077 0.465 . . . . 0.0 111.75 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -86.73 -36.25 18.75 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.668 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.486 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 7.8 mt -58.54 -48.13 81.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.221 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -38.49 84.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.965 179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.97 -6.7 55.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.185 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -102.79 -15.27 16.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.266 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.4 36.99 4.17 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.634 -0.794 . . . . 0.0 112.863 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.9 mp -141.56 91.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.72 0.295 . . . . 0.0 111.201 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.8 t -59.96 159.59 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.971 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 1.8 p90 -150.14 72.82 1.13 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.691 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -66.02 -67.98 0.4 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.083 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -140.6 32.93 1.83 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -111.67 -34.3 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.877 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -119.84 85.5 2.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.891 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -85.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.114 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.52 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -140.44 -37.18 0.46 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.479 ' N ' ' HG2' ' A' ' 114' ' ' LYS . . . -83.18 -23.81 32.74 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -85.82 -36.88 19.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.357 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.566 HD21 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -80.09 -19.64 46.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.93 -179.655 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.566 ' N ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.59 -28.13 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.06 -33.56 19.48 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.998 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.6 tp -49.24 -41.03 36.2 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.085 -179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.486 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 20.9 m-85 . . . . . 0 C--N 1.327 -0.411 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.217 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.441 HG21 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.654 0.264 . . . . 0.0 110.952 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.489 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.05 143.26 30.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.404 0.621 . . . . 0.0 112.493 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.5 p -95.54 121.67 37.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.587 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.8 150.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.025 0.441 . . . . 0.0 111.228 -179.005 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.2 p -135.82 124.54 38.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.298 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 11.3 m -93.14 104.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.369 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.36 108.02 19.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.628 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.429 ' ND2' HD11 ' A' ' 51' ' ' LEU . 8.4 t30 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.189 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 p30 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.828 0.347 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.444 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 8.9 m120 -116.34 124.46 50.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.617 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.16 145.62 26.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.464 0.649 . . . . 0.0 111.464 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.7 OUTLIER -113.41 139.9 48.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.331 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.573 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.29 157.58 37.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.161 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.46 111.44 5.32 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.761 0.791 . . . . 0.0 111.214 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.441 ' CA ' HG21 ' A' ' 7' ' ' THR . 4.5 t -127.6 168.3 20.98 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.461 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -69.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.742 0.306 . . . . 0.0 111.367 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -156.71 -16.6 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 87.6 p -42.47 -44.52 4.09 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.543 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.72 -47.03 77.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.807 0.337 . . . . 0.0 111.721 -179.606 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.456 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 6.7 tp -49.24 -55.41 12.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.469 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.87 -27.9 61.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.18 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -51.77 68.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.662 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.453 ' CB ' ' HB ' ' A' ' 53' ' ' VAL . 2.9 mm? -78.82 -44.19 23.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.875 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -17.71 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.245 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.77 -67.72 0.25 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.85 0.357 . . . . 0.0 111.56 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.91 133.58 41.04 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -84.98 48.64 2.38 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.689 2.259 . . . . 0.0 112.566 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -111.42 -38.43 4.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.85 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.429 HD11 ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -112.96 -176.51 2.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.728 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 m -116.34 128.57 73.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.213 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.453 ' HB ' ' CB ' ' A' ' 45' ' ' LEU . 3.3 p -116.09 116.27 51.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.52 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.09 120.65 29.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.239 -179.759 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.489 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -88.36 139.26 17.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.24 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.611 179.762 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.752 0.31 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -49.02 -45.81 43.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.512 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -13.91 31.2 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -106.17 144.8 32.36 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 110.71 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.407 ' OG1' ' N ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -98.98 -104.67 0.21 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.974 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.407 ' N ' ' OG1' ' A' ' 93' ' ' THR . 2.9 m -144.86 -38.71 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.763 0.316 . . . . 0.0 111.17 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -82.11 -21.2 36.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.461 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.2 OUTLIER -70.28 -52.35 23.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.289 0.566 . . . . 0.0 109.754 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.558 HD13 HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -51.81 -57.91 7.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.53 179.185 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.597 ' HE2' HD13 ' A' ' 117' ' ' LEU . 1.8 ttmt -54.3 -36.78 64.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.544 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.89 -22.19 29.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.944 0.402 . . . . 0.0 112.001 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.451 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -87.0 -39.1 15.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.275 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.544 ' HG ' ' CE1' ' A' ' 121' ' ' PHE . 1.4 mt -59.68 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.165 0.507 . . . . 0.0 110.034 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -40.03 95.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.35 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.49 -6.56 53.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.289 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -100.18 -15.24 18.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.158 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.3 28.86 9.36 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.481 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.0 mt -121.95 88.43 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.762 0.315 . . . . 0.0 111.038 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 72.8 p -58.46 140.38 54.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.454 ' CE2' ' HG3' ' A' ' 98' ' ' LYS . 15.5 p90 -138.78 74.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.24 -71.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -122.27 28.04 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.07 -31.79 6.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.922 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -134.51 107.31 7.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -79.89 -80.15 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.072 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.628 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -141.74 -37.91 0.4 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.797 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.59 -21.16 38.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.877 0.37 . . . . 0.0 110.563 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -85.74 -38.85 17.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.705 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.686 HD21 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -79.89 -19.34 48.41 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.486 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.686 ' N ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.25 -27.73 7.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.823 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.78 -33.13 18.76 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.988 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 18.1 tp -49.05 -44.15 41.49 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.306 -178.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.544 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 96.2 m-85 . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.296 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.437 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.262 0 CA-C-O 121.009 0.433 . . . . 0.0 110.884 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.44 ' H ' ' N ' ' A' ' 37' ' ' VAL . 0.2 OUTLIER -146.4 121.81 10.32 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.417 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.2 p -111.35 127.73 55.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 177.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.724 ' H ' ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.84 153.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.08 0.467 . . . . 0.0 111.613 -178.553 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.7 p -138.03 106.54 3.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 82.2 t -92.48 134.12 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.937 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -119.71 108.47 14.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.134 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.393 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.424 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.1 t-20 -122.87 128.02 49.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.589 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 61.4 m -87.26 145.44 26.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.131 0.491 . . . . 0.0 111.506 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.735 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 2.7 tm? -102.9 153.73 19.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.674 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.735 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -71.18 157.85 37.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 121.601 0.715 . . . . 0.0 112.805 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.437 ' CB ' ' OG1' ' A' ' 7' ' ' THR . . . -70.69 104.85 2.97 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.551 0.691 . . . . 0.0 110.843 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.44 ' N ' ' H ' ' A' ' 8' ' ' PHE . 1.1 t -115.43 -159.45 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.947 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.45 ' O ' ' CB ' ' A' ' 39' ' ' GLU . 4.9 m -107.74 40.82 1.64 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.725 0.297 . . . . 0.0 111.069 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.45 ' CB ' ' O ' ' A' ' 38' ' ' SER . 3.3 tt0 85.75 -18.58 0.35 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.226 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.0 m -50.44 -34.02 23.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.121 0.486 . . . . 0.0 110.323 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.596 ' CB ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.32 -44.81 76.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.383 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.455 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -57.24 -55.48 34.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.871 -179.415 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.53 -27.13 63.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -56.87 -51.04 70.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.465 ' HB3' ' HB ' ' A' ' 53' ' ' VAL . 0.5 OUTLIER -78.71 -52.96 7.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.665 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.88 -24.25 15.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.232 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.54 -29.71 1.91 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.437 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -117.85 117.79 35.31 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.763 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.05 68.44 5.8 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.455 2.104 . . . . 0.0 112.27 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mmt-85 -128.26 -43.82 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.101 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 56.6 mt -124.72 142.58 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.982 0.42 . . . . 0.0 111.143 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.29 111.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.348 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 1.4 p -98.56 118.19 44.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.127 0.489 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.9 144.79 48.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.397 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.534 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.8 pp -107.41 144.76 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.231 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 m . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.602 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.46 ' HA ' ' CD1' ' A' ' 92' ' ' PHE . 47.6 tp . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.604 0.24 . . . . 0.0 111.52 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -49.04 -50.23 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.663 0.268 . . . . 0.0 111.408 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -1.3 9.82 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.46 ' CD1' ' HA ' ' A' ' 89' ' ' LEU . 2.4 m-85 -95.06 104.68 16.56 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.79 -92.41 0.53 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.531 ' CA ' HD21 ' A' ' 97' ' ' LEU . 2.0 t -125.5 -50.79 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-O 120.884 0.373 . . . . 0.0 111.773 -179.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.34 -19.39 39.41 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.07 -25.97 29.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.56 ' HG ' ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -81.77 -53.26 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.509 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' A' ' 94' ' ' VAL . 4.7 ptpt -57.92 -29.74 65.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.116 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.71 -25.47 28.34 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.41 ' CB ' ' CZ ' ' A' ' 121' ' ' PHE . 16.2 mt-30 -86.87 -32.83 20.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.459 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.471 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 9.4 mt -61.14 -48.87 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -38.08 86.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.968 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -75.46 -6.89 52.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.957 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -113.72 13.74 18.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.007 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 58.48 60.79 8.28 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.748 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.452 HG21 HD13 ' A' ' 106' ' ' ILE . 32.2 mt -144.78 96.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.679 0.276 . . . . 0.0 111.18 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.3 p -52.72 149.63 5.97 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.786 0.327 . . . . 0.0 111.105 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -72.66 -50.93 21.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.808 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.14 160.45 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.988 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.15 76.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -178.36 -39.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.656 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.44 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -82.59 59.31 4.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.007 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.5 -71.9 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.227 -179.806 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.518 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -153.62 -41.25 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.579 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.85 -22.62 36.88 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.043 0.449 . . . . 0.0 110.199 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 81.6 mm-40 -85.94 -38.07 18.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.62 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.518 HD22 ' HA ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -77.05 -24.07 51.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.335 -179.12 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.56 ' HA ' ' HG ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.29 -26.57 7.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.182 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.98 -35.16 19.0 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.239 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 14.3 tp -50.33 -46.65 55.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.894 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.486 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 20.5 m-85 . . . . . 0 C--N 1.33 -0.281 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.42 HG21 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.46 0.075 0 CA-C-O 120.673 0.273 . . . . 0.0 110.392 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.485 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.01 145.91 31.7 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.276 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.9 p -96.18 126.43 41.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -109.89 150.68 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.109 0.481 . . . . 0.0 111.369 -178.872 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.4 p -136.98 131.14 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.682 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 6.7 m -98.39 104.59 16.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.436 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -104.6 106.71 17.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.086 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.865 0.364 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.557 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 42.4 t-20 -119.46 127.59 53.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.208 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.97 145.21 26.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.427 0.632 . . . . 0.0 111.576 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.629 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -111.15 141.8 44.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.841 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.611 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.69 156.72 39.12 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 120.998 0.428 . . . . 0.0 110.575 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.469 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -70.27 114.26 8.24 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.357 0.599 . . . . 0.0 111.32 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.462 ' CG2' ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -131.82 -170.81 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.936 -179.49 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.462 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 0.2 OUTLIER -66.67 -71.43 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -160.57 -18.15 0.05 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.6 p -42.85 -38.3 2.12 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.74 0.305 . . . . 0.0 111.813 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.538 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -58.56 -42.1 87.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.755 -179.735 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.505 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 5.4 tp -71.54 -30.3 65.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.415 -179.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.32 -27.97 20.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.588 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -69.82 -46.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.89 0.376 . . . . 0.0 110.637 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.442 HD11 ' CG1' ' A' ' 10' ' ' VAL . 65.7 mt -78.91 -31.57 45.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.176 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 42' ' ' LEU . 13.1 tttt -83.29 -15.7 49.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.298 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.51 -39.46 23.35 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.683 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -121.01 142.63 35.13 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -84.12 50.7 3.15 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.723 2.282 . . . . 0.0 112.522 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.4 ' HB3' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -97.79 -49.69 4.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.536 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.43 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -125.26 -171.22 2.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.938 179.3 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.43 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 m -110.71 143.14 21.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 111.927 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.2 p -131.43 117.6 36.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.192 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.424 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -127.46 135.06 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.068 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.493 ' HA ' HG22 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -88.63 120.35 37.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.843 179.231 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 70.8 p . . . . . 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.875 -179.981 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.6 tp . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.824 0.345 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -48.84 -30.39 5.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.741 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 t -62.05 -13.1 22.85 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.423 ' HB3' HD23 ' A' ' 97' ' ' LEU . 22.1 m-85 -108.06 159.87 16.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.633 0.254 . . . . 0.0 110.738 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 65.2 m -118.38 -97.86 0.46 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.609 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.548 ' HA ' ' CD1' ' A' ' 97' ' ' LEU . 21.2 t -139.05 -52.91 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.059 0 CA-C-O 121.198 0.523 . . . . 0.0 111.347 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -72.74 -19.85 61.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.8 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -80.68 -36.41 32.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 120.852 0.358 . . . . 0.0 110.893 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.688 HD21 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -63.32 -58.35 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.317 0.58 . . . . 0.0 109.981 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -55.06 -33.59 62.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.335 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.74 -22.01 29.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.066 0.46 . . . . 0.0 111.443 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.423 ' OE1' ' CE1' ' A' ' 92' ' ' PHE . 10.8 mt-30 -87.09 -36.8 17.93 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.524 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 9.0 mt -59.45 -48.68 80.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.199 0.523 . . . . 0.0 110.148 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -37.52 83.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.596 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.14 -6.57 59.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.265 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 -100.12 -15.22 18.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.169 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.55 -2.89 21.8 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.006 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.9 mt -109.93 78.38 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.909 0.385 . . . . 0.0 111.113 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.5 t -82.17 90.99 6.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.466 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -55.04 -177.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.107 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 9.9 mttm -148.46 -51.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.58 30.25 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.894 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -116.72 -37.48 3.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -100.99 99.86 10.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.886 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -80.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.241 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.527 ' HA ' HD22 ' A' ' 117' ' ' LEU . 8.3 ptmt -143.01 -38.9 0.34 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.734 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.05 -23.13 38.77 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -85.81 -36.86 19.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.755 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.674 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.0 -22.67 39.24 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.371 -179.419 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.688 ' HA ' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.41 -28.14 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.073 178.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.61 -33.17 18.94 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 121.209 0.528 . . . . 0.0 110.826 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -49.12 -51.21 33.32 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.692 -179.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.536 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 40.8 m-85 . . . . . 0 C--N 1.332 -0.194 0 CA-C-O 120.703 0.287 . . . . 0.0 110.982 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.489 ' HB ' ' CB ' ' A' ' 36' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.613 0.244 . . . . 0.0 110.554 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.532 ' CE2' ' NE2' ' A' ' 41' ' ' GLN . 0.5 OUTLIER -144.79 143.53 30.7 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.557 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -89.36 125.12 35.0 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.873 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -110.31 149.11 13.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.364 0.602 . . . . 0.0 112.011 -178.395 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.5 p -138.6 126.67 28.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.452 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.409 ' CG1' ' CD1' ' A' ' 45' ' ' LEU . 16.9 m -93.82 104.69 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.549 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.88 106.56 18.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.427 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 t30 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.07 0.462 . . . . 0.0 111.09 -179.69 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.3 p-10 . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 120.921 0.391 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.8 m-20 -119.16 137.86 53.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.079 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.19 145.08 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.359 0.599 . . . . 0.0 111.484 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.656 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -115.07 143.4 45.25 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.93 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.656 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.33 157.38 37.84 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 121.179 0.514 . . . . 0.0 111.044 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.489 ' CB ' ' HB ' ' A' ' 7' ' ' THR . . . -69.56 111.34 5.32 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.686 0.755 . . . . 0.0 111.987 -177.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 t -129.93 179.67 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.489 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.79 72.61 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.508 ' HA ' ' NE2' ' A' ' 41' ' ' GLN . 0.4 OUTLIER 78.52 -16.65 0.65 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 178.396 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 t -62.58 -21.37 65.56 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -84.61 -25.77 28.35 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.376 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 46' ' ' LYS . 7.5 tp -74.36 -54.72 7.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.96 0.41 . . . . 0.0 110.977 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.63 -21.48 66.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.184 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -48.38 21.61 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.426 HD11 ' CG1' ' A' ' 10' ' ' VAL . 59.1 mt -78.83 -30.75 45.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.284 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -77.28 -10.26 59.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.373 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.69 -47.94 29.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.794 0.331 . . . . 0.0 111.44 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.5 123.08 64.8 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -80.6 55.28 5.61 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.579 2.186 . . . . 0.0 112.455 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -135.58 -43.07 0.68 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.97 -176.5 4.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.479 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.52 108.83 19.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.775 0.321 . . . . 0.0 111.599 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.8 p -98.93 111.77 29.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.195 0.521 . . . . 0.0 110.295 179.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -127.04 144.66 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.295 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.545 ' HA ' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -100.03 133.13 44.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.353 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.782 179.967 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.527 0.061 0 CA-C-O 120.805 0.336 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -48.82 -41.79 34.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.341 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.87 -13.78 27.68 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.439 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 6.2 m-85 -106.29 104.53 14.25 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.437 ' O ' HD21 ' A' ' 97' ' ' LEU . 66.5 p -89.44 -85.54 0.2 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.997 -178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.598 ' HA ' HD23 ' A' ' 97' ' ' LEU . 24.2 t -145.5 -56.52 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.957 0.408 . . . . 0.0 111.309 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -73.44 -19.25 61.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.005 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -81.99 -20.8 37.76 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.734 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.686 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -78.5 -58.27 3.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -55.34 -29.66 58.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.345 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.81 -30.32 24.65 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.064 0.459 . . . . 0.0 112.022 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.429 ' HB2' ' CZ ' ' A' ' 121' ' ' PHE . 3.9 mm-40 -86.5 -22.02 26.64 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.696 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.513 ' HG ' ' CE1' ' A' ' 121' ' ' PHE . 1.2 mt -76.87 -42.2 40.81 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.333 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -43.39 94.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.377 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -6.33 53.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.176 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 104' ' ' ARG . 0.7 OUTLIER -108.56 -15.46 14.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.153 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.513 ' O ' ' CG2' ' A' ' 106' ' ' ILE . . . 144.25 -54.6 0.57 Allowed Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.179 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.513 ' CG2' ' O ' ' A' ' 105' ' ' GLY . 9.4 tp 52.27 136.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-O 121.457 0.646 . . . . 0.0 112.725 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 18.1 p -156.36 26.68 0.35 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.545 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.478 ' CZ ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.82 87.52 0.14 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.644 -179.535 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -67.14 70.9 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 51.28 27.3 3.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.6 p -117.43 -29.23 5.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.268 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.485 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -85.22 76.05 10.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.81 0.338 . . . . 0.0 111.386 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -70.59 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.983 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.1 mttp -154.09 -42.24 0.09 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.73 0.3 . . . . 0.0 111.477 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.29 -23.9 40.39 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.926 0.393 . . . . 0.0 110.143 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.8 mt-10 -85.97 -37.37 19.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.452 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.578 HD22 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -77.88 -19.82 54.1 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.913 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.578 ' N ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -82.85 -27.85 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.997 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.3 -34.74 18.77 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.84 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 tp -49.9 -40.43 42.97 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.447 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.513 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 6.0 m-85 . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.287 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.409 HG23 ' N ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.675 0.274 . . . . 0.0 110.646 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.505 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.23 144.67 30.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.366 0.603 . . . . 0.0 112.619 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.69 130.06 36.02 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.638 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.24 152.61 12.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 112.079 -178.557 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.5 p -138.47 102.1 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.316 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.413 HG23 ' CD2' ' A' ' 45' ' ' LEU . 42.9 t -92.49 130.25 41.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.18 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -125.0 106.62 10.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.866 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.694 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.768 0.318 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 10.1 m-20 -126.38 131.78 51.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.236 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.4 m -87.22 145.76 26.26 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.167 0.508 . . . . 0.0 111.162 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.628 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -115.34 141.16 48.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.118 -179.847 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.623 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.67 157.3 38.23 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.9 0.381 . . . . 0.0 110.219 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.425 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.2 114.58 7.59 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.742 0.782 . . . . 0.0 111.352 -177.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.409 ' N ' HG23 ' A' ' 7' ' ' THR . 11.1 t -127.79 167.91 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.775 -179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.39 -53.71 47.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.595 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.74 -20.62 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.38 -33.1 0.6 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.825 0.345 . . . . 0.0 111.473 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.608 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.1 -57.85 11.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.771 179.618 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.41 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 8.8 tp -53.05 -55.47 23.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.874 -178.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.33 -30.94 70.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.489 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -53.08 -54.62 32.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.364 . . . . 0.0 110.661 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.413 ' CD2' HG23 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -79.07 -54.45 5.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.062 179.783 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -49.26 -25.94 2.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.511 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.19 -30.2 1.13 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.541 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -112.5 121.73 38.17 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.774 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -77.19 69.58 7.05 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.468 2.112 . . . . 0.0 112.266 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.35 -40.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.173 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.22 124.45 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.754 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.5 t -69.7 106.11 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.999 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.0 p -107.13 117.73 53.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.703 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.408 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.07 142.96 51.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.084 -178.665 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.555 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.2 pt -93.8 126.78 46.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.28 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.59 179.692 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 3.0 mm? . . . . . 0 CA--C 1.525 0.018 0 CA-C-O 120.856 0.36 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -54.62 -50.28 68.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.332 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.8 m -62.41 -14.63 42.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 89' ' ' LEU . 4.3 m-85 -71.75 -14.45 62.01 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 122.24 -0.287 . . . . 0.0 111.26 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.431 ' O ' ' CG1' ' A' ' 118' ' ' ILE . 0.2 OUTLIER 57.74 -148.72 0.48 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.968 179.293 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.705 ' HA ' HD22 ' A' ' 97' ' ' LEU . 4.0 m -127.44 -32.08 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.166 0.508 . . . . 0.0 110.993 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.6 -19.55 38.18 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -23.6 40.13 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.823 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.705 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -84.78 -48.92 8.91 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.18 179.8 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.44 ' H ' HD21 ' A' ' 97' ' ' LEU . 0.8 OUTLIER -57.89 -35.67 71.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.611 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.16 -23.97 28.15 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.481 ' HG2' ' CE1' ' A' ' 121' ' ' PHE . 1.0 OUTLIER -86.52 -37.89 17.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.664 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.471 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 1.9 mt -59.34 -46.98 87.13 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.454 HG21 ' CE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -59.93 -43.08 95.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.961 179.297 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -72.62 -6.78 46.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.051 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -105.98 -15.43 14.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.87 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 63.05 63.85 4.25 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.725 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.5 mm -116.59 -86.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.587 0.194 . . . . 0.0 111.109 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.3 t 169.88 150.13 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.454 ' CE1' HG21 ' A' ' 102' ' ' THR . 13.4 p90 -171.89 92.27 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.971 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -176.79 135.4 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.883 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 68.84 -67.11 0.22 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.873 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.3 p -65.88 -68.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.71 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -79.98 179.56 7.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.965 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -172.34 -80.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.749 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.21 -57.49 0.65 Allowed 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.422 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.71 -35.03 79.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.148 0.499 . . . . 0.0 109.954 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -86.84 -33.95 19.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.756 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.439 ' CD2' ' HE3' ' A' ' 98' ' ' LYS . 1.7 tp -74.67 -37.47 62.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.896 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.635 ' HA ' ' HG ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -77.56 -28.31 15.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.101 179.651 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.75 -32.5 20.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 121.077 0.465 . . . . 0.0 110.872 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.7 mt -54.98 -40.36 69.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.641 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.541 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.4 m-85 . . . . . 0 C--N 1.331 -0.218 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.676 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.428 ' HB ' ' CB ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.582 0.229 . . . . 0.0 110.785 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.492 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.07 137.12 25.77 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.7 p -87.91 124.41 33.65 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.02 157.72 10.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 CA-C-O 120.923 0.392 . . . . 0.0 111.385 -178.625 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 1.4 p -138.51 108.97 4.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.112 0.482 . . . . 0.0 110.537 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.449 ' CG2' ' CD1' ' A' ' 45' ' ' LEU . 2.5 t -92.68 135.9 26.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.23 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -116.72 113.34 22.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.757 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-O 121.039 0.447 . . . . 0.0 110.951 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.773 0.321 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -114.73 123.39 49.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.848 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -87.44 145.73 26.15 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.331 0.586 . . . . 0.0 111.629 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.629 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.5 OUTLIER -114.91 139.08 50.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.945 179.671 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.557 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.8 156.4 39.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -70.63 116.73 11.29 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.415 0.626 . . . . 0.0 111.384 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.431 ' CG2' ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -130.19 -171.69 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.849 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.431 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 44.3 p -59.77 -58.63 7.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.172 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 179.88 -16.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.4 t -42.54 -34.76 0.91 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.569 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -58.9 -48.75 80.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.843 0.354 . . . . 0.0 111.356 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.452 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 9.3 tp -55.55 -50.11 70.91 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.406 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.25 -29.67 54.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.444 -179.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -58.59 -46.57 86.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.119 0.485 . . . . 0.0 110.15 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.449 ' CD1' ' CG2' ' A' ' 12' ' ' VAL . 4.5 mt -78.95 -48.15 15.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.704 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -64.12 -16.72 62.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.291 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.53 -41.94 14.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.807 0.337 . . . . 0.0 111.462 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.83 121.37 51.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.84 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.54 62.6 6.33 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.57 2.18 . . . . 0.0 112.3 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.78 -46.14 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 44.6 mt -92.26 144.49 25.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.993 0.425 . . . . 0.0 111.187 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.69 108.18 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.935 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.434 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 1.3 p -104.66 121.39 56.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.971 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.468 ' O ' HG23 ' A' ' 10' ' ' VAL . 9.0 pm0 -126.92 133.39 50.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.635 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.555 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -97.98 131.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.446 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.3 m . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.459 179.523 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.528 0.114 0 CA-C-O 120.617 0.246 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -49.06 -50.29 37.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.393 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 t -62.19 -15.08 44.09 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.44 ' C ' HD13 ' A' ' 97' ' ' LEU . 61.9 m-85 -114.22 103.5 11.16 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.697 0.284 . . . . 0.0 110.29 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.435 ' N ' HD13 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -94.55 -80.87 0.4 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.593 -179.579 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.651 ' HA ' HD23 ' A' ' 97' ' ' LEU . 28.1 t -147.33 -56.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.81 0.338 . . . . 0.0 111.302 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -19.59 60.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.981 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.434 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -82.65 -21.28 35.05 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.514 -179.362 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -75.6 -58.47 3.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -57.12 -29.13 63.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.29 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.9 23.95 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.434 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 7.3 mm-40 -84.17 -28.01 27.67 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.216 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.478 ' HG ' ' CE1' ' A' ' 121' ' ' PHE . 1.1 mt -69.78 -45.73 67.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.849 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.486 ' HA ' ' HB ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -57.33 -45.29 84.4 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.373 179.541 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -75.52 -6.32 49.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.413 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -114.76 24.17 12.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.599 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.61 -32.09 6.87 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.743 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.486 ' HB ' ' HA ' ' A' ' 102' ' ' THR . 0.5 OUTLIER 43.9 96.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 112.106 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -118.16 28.23 8.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.512 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.437 ' CZ ' HD12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -69.34 -177.74 1.21 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.096 -179.79 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.43 165.91 12.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.96 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -26.12 42.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.943 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -82.58 0.89 40.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.387 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.82 77.53 0.08 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.785 0.326 . . . . 0.0 111.005 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 70.5 p -77.05 -79.75 0.11 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.979 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.578 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.1 pptp? -146.55 -39.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.667 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.82 -23.75 38.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.94 0.4 . . . . 0.0 110.714 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -85.92 -37.2 19.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.502 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.614 HD22 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.65 -19.33 41.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.947 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.614 ' N ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.48 -26.27 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.101 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.52 -34.31 20.04 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.819 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.98 -41.57 64.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.077 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.478 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 4.6 m-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.42 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.497 -0.241 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.35 154.97 51.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.831 0.348 . . . . 0.0 110.979 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -152.64 165.57 34.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.794 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.8 mtp 58.93 29.95 19.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.9 p-10 -165.43 152.92 10.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.907 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.59 79.15 1.19 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.994 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.433 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 6.3 t -112.37 130.25 56.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.782 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.451 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.82 152.99 38.59 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -98.88 122.93 42.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.59 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.22 155.63 11.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.007 0.432 . . . . 0.0 111.873 -178.47 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.541 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -135.71 134.91 51.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.113 0.482 . . . . 0.0 111.201 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 14.1 m -102.36 107.52 22.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.039 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.72 106.46 18.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.594 HD22 ' HB ' ' A' ' 16' ' ' ILE . 53.8 t30 -115.84 146.61 41.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.371 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.401 ' HA ' HD12 ' A' ' 29' ' ' LEU . 15.0 ttt180 -130.08 35.87 4.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.321 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.594 ' HB ' HD22 ' A' ' 14' ' ' ASN . 15.9 mt -84.72 -83.38 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.03 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.428 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . 7.7 ptpt -158.57 -174.64 4.88 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -102.89 31.57 4.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.909 0.385 . . . . 0.0 110.612 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -153.29 22.61 0.76 Allowed Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.753 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.483 ' CZ ' ' HB3' ' A' ' 27' ' ' PHE . 32.2 p90 -76.79 -17.15 59.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.768 0.318 . . . . 0.0 110.557 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 21' ' ' ARG . 1.7 mmt-85 56.89 -174.46 0.07 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.347 0.594 . . . . 0.0 112.007 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.46 ' HG3' ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -169.68 -155.14 0.13 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.174 179.464 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -42.46 -29.91 0.31 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.722 0.296 . . . . 0.0 111.675 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.36 45.07 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.17 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.456 ' HB2' ' CE1' ' A' ' 27' ' ' PHE . 40.8 m-85 -128.67 21.95 5.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.658 0.266 . . . . 0.0 111.283 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 48.08 45.25 19.47 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.002 0.429 . . . . 0.0 110.946 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 20' ' ' TYR . 3.3 m-30 -49.16 115.55 1.34 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.242 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -87.7 172.17 9.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.089 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.428 ' CD2' ' HA ' ' A' ' 17' ' ' LYS . 2.4 tp -75.11 100.46 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.685 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 165.69 -152.71 22.23 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.589 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER -109.29 129.1 55.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.872 0.368 . . . . 0.0 111.01 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.541 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.7 t-20 -116.36 130.53 56.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.1 m -86.96 145.14 26.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.455 0.645 . . . . 0.0 111.625 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.626 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.41 142.14 44.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.865 179.717 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.626 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.34 157.56 37.53 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.11 0.481 . . . . 0.0 110.773 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.2 105.15 2.4 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.764 0.792 . . . . 0.0 111.095 -177.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 5.6 t -123.66 166.48 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.047 0 CA-C-N 114.205 -1.362 . . . . 0.0 110.617 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.406 ' O ' ' CZ ' ' A' ' 8' ' ' PHE . 11.3 t -52.09 -73.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.351 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -156.5 -16.69 0.1 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -43.03 -45.88 5.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.879 0.371 . . . . 0.0 111.408 -179.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.624 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -44.24 -60.92 1.69 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.204 179.562 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 46' ' ' LYS . 11.4 tp -52.01 -55.38 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.784 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -35.07 79.08 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 40' ' ' SER . 2.6 tp60 -68.2 -41.8 80.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.852 0.358 . . . . 0.0 111.061 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.412 ' CB ' ' HB ' ' A' ' 53' ' ' VAL . 68.2 mt -78.74 -31.24 46.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.61 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -79.64 -29.8 41.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 110.865 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.53 -29.7 59.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.185 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -93.19 110.15 44.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.764 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.85 58.78 6.62 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.514 2.143 . . . . 0.0 112.418 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -140.97 -45.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.428 HD13 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -107.75 175.35 5.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.545 179.796 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.9 m -110.67 146.04 16.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.96 0.41 . . . . 0.0 111.984 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.412 ' HB ' ' CB ' ' A' ' 45' ' ' LEU . 3.2 p -130.82 116.32 33.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.818 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.489 ' O ' HG23 ' A' ' 10' ' ' VAL . 3.0 mm-40 -127.47 131.43 50.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.48 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.548 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.8 pt -88.75 132.3 33.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.586 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 39.1 p -122.26 104.5 9.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.489 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -104.89 92.72 4.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.986 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.6 t -68.33 83.08 0.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 141.57 44.02 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.526 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.0 p -178.52 99.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.76 0.314 . . . . 0.0 110.858 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -98.55 34.25 2.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.09 148.01 29.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.872 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 109.99 -102.76 1.61 Allowed Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.488 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.39 -35.53 4.33 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.476 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 60.72 111.28 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.867 0.365 . . . . 0.0 110.889 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -96.62 28.48 13.27 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.478 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.19 104.55 14.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.807 0.337 . . . . 0.0 110.857 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.7 m -89.3 -46.8 8.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.886 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -71.56 165.89 22.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.886 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.412 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 1.2 tm-20 178.19 -53.21 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.907 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.412 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 48.8 Cg_exo -55.95 -43.9 52.39 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.44 2.093 . . . . 0.0 112.193 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -86.15 167.13 15.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.085 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 129.96 99.61 0.88 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.467 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 t 60.58 80.18 0.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.816 0.341 . . . . 0.0 110.875 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -84.97 129.13 34.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.919 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.29 -44.4 2.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.786 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -137.59 132.38 33.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.911 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.4 mttt -157.7 -65.07 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.92 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 60.85 92.89 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.824 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mp 64.45 -79.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.827 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.12 92.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.1 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -167.59 -56.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.09 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -141.19 138.0 17.35 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.816 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.52 134.57 33.5 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.41 2.073 . . . . 0.0 112.214 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.28 -61.8 0.42 Allowed 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.356 2.037 . . . . 0.0 112.314 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m 60.25 31.39 20.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.893 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.8 m -125.09 79.11 1.77 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.957 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -141.78 -61.39 0.46 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.718 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.5 tp -74.87 -31.56 61.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.713 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -44.09 41.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.556 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.88 -14.87 38.01 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -93.66 104.19 16.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.825 0.345 . . . . 0.0 110.521 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 68.0 m -79.94 -97.61 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.458 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.5 t -142.89 -41.85 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.942 0.401 . . . . 0.0 111.246 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 98' ' ' LYS . 9.8 pt-20 -77.77 -20.88 52.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.618 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -51.01 24.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.221 0.534 . . . . 0.0 109.912 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.603 HD12 HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -50.86 -58.3 6.32 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.904 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' A' ' 95' ' ' GLU . 3.4 ptpt -56.87 -33.31 66.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.727 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.1 -24.15 28.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.982 0.42 . . . . 0.0 112.004 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.466 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 1.3 tp60 -87.09 -37.8 17.08 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.533 ' HG ' ' CE1' ' A' ' 121' ' ' PHE . 1.2 mt -60.07 -46.94 87.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.033 0.444 . . . . 0.0 110.081 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -39.83 90.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.179 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.12 -6.58 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.125 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -101.75 -15.34 17.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.14 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.29 39.2 3.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.58 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 29.6 mt -141.58 85.08 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.762 0.315 . . . . 0.0 111.169 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.6 t -62.08 157.92 17.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.448 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 2.0 p90 -152.39 101.13 2.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.971 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.51 -52.49 2.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.823 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -83.16 -59.1 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.767 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.1 t -88.08 -167.83 2.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.717 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.457 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . 54.65 48.71 19.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.031 0.444 . . . . 0.0 111.087 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.32 -70.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.611 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -157.53 -39.87 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.328 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -21.47 33.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.003 0.43 . . . . 0.0 109.993 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 9.5 mm-40 -85.84 -38.79 17.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.658 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.679 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -78.06 -20.14 52.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.611 -0.435 . . . . 0.0 111.524 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.679 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -28.0 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.779 177.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.58 -31.81 19.66 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.18 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.8 OUTLIER -49.05 -53.11 21.71 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.147 -178.751 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.533 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 88.5 m-85 -55.28 85.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 111.416 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -128.61 131.7 23.92 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.074 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.54 90.33 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.422 2.082 . . . . 0.0 112.321 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -153.6 37.87 0.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.07 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.27 103.56 9.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.881 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 163.77 -81.45 0.12 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.507 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -149.18 -56.78 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.784 0.326 . . . . 0.0 110.853 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -165.73 75.64 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.874 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 11.5 m -90.8 156.81 17.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -130.61 84.25 2.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.051 179.984 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.531 -0.228 . . . . 0.0 112.531 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 p -109.43 -13.44 14.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.646 0.26 . . . . 0.0 111.307 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 64.22 -174.16 0.17 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.805 0.336 . . . . 0.0 110.867 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 67.78 27.84 7.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 57.71 106.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.945 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.11 124.98 4.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.957 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.684 ' HA ' ' O ' ' A' ' 37' ' ' VAL . 2.0 t -135.64 130.89 35.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.813 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.547 ' CE2' ' HB ' ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.52 145.61 30.22 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.0 p -123.56 121.19 35.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.944 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.679 ' H ' ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.75 152.43 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 111.915 -178.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.6 p -127.43 137.31 58.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.68 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 15.7 m -110.78 104.65 17.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -90.66 106.33 18.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.748 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -96.83 145.45 25.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.026 0.441 . . . . 0.0 111.535 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -146.85 35.29 0.93 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.268 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.1 mt -101.12 -54.44 6.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.357 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.0 ptmt -153.62 -96.69 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.096 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -137.43 50.36 1.97 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.079 0.466 . . . . 0.0 109.905 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.461 ' O ' ' HB3' ' A' ' 20' ' ' TYR . . . 113.82 -66.4 0.27 Allowed Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.197 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.461 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 53.8 t80 79.98 -20.28 0.39 Allowed 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 122.544 0.338 . . . . 0.0 111.642 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.467 ' HD2' ' CG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER 165.16 167.9 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.921 0.391 . . . . 0.0 111.28 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 173.19 -80.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.2 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.37 17.36 23.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.71 26.56 5.27 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.732 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.4 153.68 11.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.613 0.244 . . . . 0.0 110.373 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.31 100.08 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 110.637 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' O ' ' CG ' ' A' ' 28' ' ' HIS . 2.7 t80 -55.65 -107.55 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.056 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.531 ' CG ' ' O ' ' A' ' 27' ' ' PHE . 96.8 m-70 -163.73 170.0 17.62 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.894 0.378 . . . . 0.0 110.722 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.3 107.03 18.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.429 179.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 166.06 -142.45 7.67 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.19 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.423 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -143.35 131.5 21.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.893 0.377 . . . . 0.0 111.329 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.488 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 2.3 t-20 -124.06 138.27 54.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.08 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.07 145.05 26.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.361 0.601 . . . . 0.0 111.511 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.681 HD12 ' O ' ' A' ' 35' ' ' ALA . 1.6 tm? -101.29 150.91 22.5 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.643 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.681 ' O ' HD12 ' A' ' 34' ' ' LEU . . . -70.73 156.64 39.25 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 121.742 0.782 . . . . 0.0 112.828 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -71.18 105.02 3.26 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.924 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.684 ' O ' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -123.46 -170.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.955 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 p -85.66 43.01 1.0 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 79.23 -16.51 0.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -44.85 -34.15 2.23 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.125 0.488 . . . . 0.0 110.586 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.565 ' OE1' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -56.99 -44.24 82.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.258 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.9 tp -56.46 -55.63 31.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.147 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -26.18 55.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.557 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -49.4 75.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.821 0.343 . . . . 0.0 110.594 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HB3' ' HB ' ' A' ' 53' ' ' VAL . 11.4 mt -79.06 -46.55 17.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -54.93 -22.56 15.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.346 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.01 -70.77 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.639 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -64.07 117.2 33.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.858 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -80.57 87.27 1.53 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.509 2.14 . . . . 0.0 112.546 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.43 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 1.1 tpt180 -168.15 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.917 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.467 ' CG ' ' HD2' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -93.87 174.85 6.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.505 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -115.91 106.86 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.279 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.404 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 2.1 p -99.02 115.71 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.54 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -108.77 130.36 55.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.823 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.547 ' HB ' ' CE2' ' A' ' 8' ' ' PHE . 1.3 pp -107.64 105.48 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.721 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.94 104.63 9.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.761 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.456 ' CB ' ' CZ ' ' A' ' 8' ' ' PHE . 2.3 tm-20 -128.12 64.67 1.39 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.904 0.383 . . . . 0.0 111.032 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.8 t -154.85 39.14 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -129.31 178.56 17.28 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.512 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.2 t -107.27 -19.89 13.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.722 0.296 . . . . 0.0 111.171 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 67.44 94.86 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.89 0.376 . . . . 0.0 110.895 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -96.28 41.66 1.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.895 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 163.92 124.6 0.72 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.518 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.33 -74.85 0.34 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.458 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 60.91 100.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.831 0.348 . . . . 0.0 110.879 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 160.97 127.05 0.86 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.552 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.87 130.87 47.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.83 0.348 . . . . 0.0 110.828 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.1 t -119.09 -37.95 3.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.052 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.83 161.94 0.13 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.839 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -91.38 140.48 25.54 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.971 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -56.68 -163.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.466 2.111 . . . . 0.0 112.337 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 58.79 -177.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.121 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 147.31 59.74 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.525 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.4 m -126.33 -177.66 4.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.828 0.347 . . . . 0.0 110.878 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -94.74 -65.63 0.97 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.948 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -90.55 116.4 28.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.867 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -164.7 100.44 0.79 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.933 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -176.13 -45.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.89 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.58 121.81 23.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 pp -153.63 129.19 9.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.911 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -162.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.689 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -122.45 -39.59 2.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.325 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.507 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 5.1 m-20 -81.03 -68.93 0.2 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.33 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.507 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 7.9 Cg_exo -40.45 -48.5 4.22 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.693 2.262 . . . . 0.0 112.745 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.447 ' HD3' ' CB ' ' A' ' 84' ' ' PRO . 21.8 Cg_exo -64.93 159.66 45.04 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.399 2.066 . . . . 0.0 112.142 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 54.77 79.04 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.013 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 75.3 p -85.88 -78.1 0.28 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.846 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.46 -54.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.674 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.417 ' CD2' HG12 ' A' ' 118' ' ' ILE . 18.9 tp -79.01 -25.65 43.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.015 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -49.04 -47.6 44.55 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.532 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.08 -13.06 22.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -94.66 -20.9 19.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 120.644 0.259 . . . . 0.0 111.18 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.6 p 61.13 -147.92 0.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.953 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.694 ' HA ' HD13 ' A' ' 97' ' ' LEU . 21.5 t -120.34 -54.92 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.073 0 CA-C-O 121.012 0.434 . . . . 0.0 111.512 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -65.08 -19.96 66.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.971 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.7 OUTLIER -76.33 -37.88 56.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 120.774 0.321 . . . . 0.0 110.784 -178.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.694 HD13 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -64.04 -58.5 6.49 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.766 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.412 ' HD2' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -54.23 -35.07 62.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.976 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.03 -23.66 28.51 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.43 ' O ' ' N ' ' A' ' 104' ' ' ARG . 6.2 mm-40 -86.78 -39.96 15.44 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.447 HD21 ' CZ ' ' A' ' 121' ' ' PHE . 0.8 OUTLIER -55.94 -48.78 75.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.194 0.521 . . . . 0.0 109.945 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -40.59 96.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.422 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -80.38 -6.35 57.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.433 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' A' ' 100' ' ' GLN . 5.0 ttt180 -97.87 -15.45 20.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.307 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 108.62 15.08 14.15 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.274 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.3 -30.88 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.111 0.456 . . . . 0.0 110.758 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.7 p 47.29 28.54 1.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.614 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.429 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 1.1 m-85 60.62 -174.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.525 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -177.46 173.82 1.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.889 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -31.06 60.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.82 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.32 -29.94 14.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.643 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -80.99 58.82 3.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.06 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -70.69 -66.51 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.404 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 10.4 ptpp? -159.0 -45.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.61 -21.64 59.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.912 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -85.16 -37.52 20.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.997 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.458 ' CD1' HD11 ' A' ' 97' ' ' LEU . 4.0 pp -71.23 -38.03 71.98 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.001 0.429 . . . . 0.0 110.382 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.454 ' N ' ' CD1' ' A' ' 117' ' ' LEU . 1.7 tt -70.03 -26.56 30.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.121 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.92 -33.47 19.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.077 0.465 . . . . 0.0 111.173 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.16 -36.0 82.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.839 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.502 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 5.8 m-85 -63.95 82.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.913 0.387 . . . . 0.0 111.277 -179.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -134.19 154.07 79.85 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.904 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.05 73.85 0.35 Allowed 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.51 2.14 . . . . 0.0 112.307 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -133.65 -46.58 0.81 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.155 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -64.47 166.36 8.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.946 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -76.27 -47.78 10.37 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.52 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -62.39 147.45 48.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.83 0.348 . . . . 0.0 110.807 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.45 157.0 17.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.85 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.25 109.04 2.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.877 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -76.51 -41.56 46.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.147 -179.994 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.6 p -178.21 108.36 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.76 0.314 . . . . 0.0 110.785 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -156.95 89.25 1.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.154 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 5.0 mtm -72.86 -74.46 0.17 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.468 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.66 176.57 8.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.16 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -177.37 109.91 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.789 0.328 . . . . 0.0 111.715 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 37' ' ' VAL . 6.4 t -153.0 129.34 10.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.261 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.506 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.87 153.66 39.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.546 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 18.6 p -92.38 124.86 36.74 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.554 HG21 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 154.25 11.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.044 0.449 . . . . 0.0 111.334 -178.591 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.787 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.26 128.56 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 121.095 0.474 . . . . 0.0 112.035 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.407 ' CG1' ' CD1' ' A' ' 45' ' ' LEU . 1.7 m -96.92 104.53 15.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.773 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -107.96 106.58 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.621 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -136.8 146.6 45.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.938 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -134.03 87.83 2.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.702 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.5 mt -128.56 -59.19 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.481 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.41 6.31 1.89 Allowed 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 50.57 26.52 2.46 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.928 0.394 . . . . 0.0 110.931 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 176.2 67.77 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.902 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.409 ' CD1' ' O ' ' A' ' 20' ' ' TYR . 1.3 t80 -103.63 28.53 6.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 -179.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' O ' ' CD1' ' A' ' 27' ' ' PHE . 6.9 mmt85 59.08 176.29 0.07 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.482 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -177.83 -89.31 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.723 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.78 -34.39 18.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.238 0.542 . . . . 0.0 110.516 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 160.14 41.43 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.116 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.414 ' CE1' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -166.49 169.22 14.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.575 -0.312 . . . . 0.0 110.53 -179.091 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.93 64.23 4.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.651 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.42 ' CD1' ' O ' ' A' ' 21' ' ' ARG . 0.4 OUTLIER -52.82 127.75 24.48 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.736 -179.919 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -70.8 108.77 4.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.896 0.379 . . . . 0.0 110.483 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.5 mp -46.95 -29.25 1.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.153 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -45.35 169.26 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.752 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -54.67 119.22 5.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.186 0.517 . . . . 0.0 111.997 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.787 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 t-20 -122.05 127.89 50.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.473 -0.785 . . . . 0.0 108.926 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 p -86.43 145.46 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.718 0.771 . . . . 0.0 112.653 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.613 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -122.09 141.33 51.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.149 179.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.613 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -71.16 155.92 40.18 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.141 0.496 . . . . 0.0 110.923 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.506 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -71.13 109.88 5.47 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.418 0.627 . . . . 0.0 111.838 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.7 OUTLIER -129.13 179.42 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.809 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.427 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 0.6 OUTLIER -51.22 -83.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.303 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.424 ' HA ' ' NE2' ' A' ' 41' ' ' GLN . 3.9 tt0 -148.02 -16.57 0.35 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.52 -47.31 5.1 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.551 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 1.2 pp0? -52.23 -27.69 15.75 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.44 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.3 tp -81.81 -39.8 23.48 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.843 0.354 . . . . 0.0 110.846 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.3 -21.46 33.23 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.422 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -70.5 -49.96 42.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 110.563 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.413 HD13 ' CG1' ' A' ' 10' ' ' VAL . 35.5 mt -78.79 -36.64 42.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.947 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -67.37 -28.57 68.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.863 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.79 -28.3 3.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.228 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -101.97 104.41 35.75 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.761 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.78 66.43 4.86 Favored 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.486 2.124 . . . . 0.0 112.246 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.48 -39.1 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.309 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.83 -167.29 1.37 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.669 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.13 106.75 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.908 0.385 . . . . 0.0 111.883 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.6 p -103.21 111.74 34.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.12 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.27 144.85 50.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.528 -179.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.554 ' HA ' HG21 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -103.9 128.56 57.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.181 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 62.4 p -122.43 104.63 9.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.772 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -94.89 78.66 3.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.789 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -112.23 -179.85 3.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.955 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 147.45 -138.95 7.51 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.369 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 m -86.7 154.7 20.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.774 0.321 . . . . 0.0 110.884 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -69.88 78.4 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.933 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -80.15 147.12 31.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.964 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 83.06 -151.56 28.79 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.488 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.49 -65.09 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.485 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -123.38 120.38 32.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.882 0.372 . . . . 0.0 110.926 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 153.02 -75.24 0.24 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.42 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 mp -81.69 122.0 27.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.797 0.332 . . . . 0.0 110.842 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 t -157.19 136.88 12.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.956 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt 60.65 102.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.928 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.624 ' HB2' ' HD3' ' A' ' 71' ' ' PRO . 17.4 mt-10 -156.01 -53.16 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.479 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.624 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 32.0 Cg_exo -62.16 176.94 1.27 Allowed 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.171 1.914 . . . . 0.0 112.241 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 61.03 30.63 19.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.12 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -84.51 92.22 1.71 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.486 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 p -175.98 -44.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.821 0.344 . . . . 0.0 110.818 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -110.62 -32.48 6.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -76.67 -55.13 5.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.88 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -59.84 -50.77 72.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.914 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -84.04 137.84 33.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.776 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -132.41 154.5 49.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.947 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.52 -53.09 4.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.869 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.65 49.89 9.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.863 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -154.65 -68.43 0.13 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.202 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.465 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 1.0 OUTLIER -70.28 -65.28 1.11 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.113 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.465 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 2.4 Cg_endo -43.26 -57.84 1.61 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.705 2.27 . . . . 0.0 112.715 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.439 ' HD3' ' HG2' ' A' ' 84' ' ' PRO . 60.3 Cg_endo -71.92 -167.92 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.39 2.06 . . . . 0.0 112.372 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.22 161.15 14.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.802 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -138.79 126.46 22.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.923 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 60.28 176.65 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.938 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 30.7 tp 70.07 -56.75 0.58 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.421 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -49.05 -49.49 41.1 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.801 0.334 . . . . 0.0 111.256 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -13.87 32.61 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.429 ' HB3' ' CD1' ' A' ' 118' ' ' ILE . 2.5 m-85 -79.23 139.31 37.95 Favored 'General case' 0 C--O 1.231 0.127 0 O-C-N 122.196 -0.315 . . . . 0.0 110.604 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.93 -70.21 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.221 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.546 ' HA ' HD13 ' A' ' 97' ' ' LEU . 39.9 t -153.27 -44.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.004 0.431 . . . . 0.0 111.405 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -20.69 38.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.642 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -76.1 -45.01 36.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 -179.334 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.546 HD13 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -59.32 -59.61 5.18 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.396 0.617 . . . . 0.0 110.27 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.448 ' HE3' HD23 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -58.29 -30.74 66.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.02 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.66 -21.4 30.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.598 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.43 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 0.0 OUTLIER -85.0 -37.55 20.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.579 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.541 ' HG ' ' CZ ' ' A' ' 121' ' ' PHE . 5.0 mt -64.57 -45.49 86.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 109.573 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -40.34 96.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.857 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -77.31 -6.73 54.31 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.249 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -102.01 -15.22 16.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.024 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 77.91 61.42 2.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.376 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.436 ' CG2' HD22 ' A' ' 101' ' ' LEU . 6.3 tt -151.66 93.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.785 0.326 . . . . 0.0 111.142 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.01 140.93 6.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.068 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.571 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -121.9 -86.41 0.65 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.779 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 51.84 103.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.802 0.334 . . . . 0.0 111.346 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 64.04 178.22 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.411 . . . . 0.0 111.009 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 2.4 m 56.46 23.01 7.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.037 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . 168.14 75.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.04 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.75 -81.55 0.05 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.731 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.581 ' O ' HG21 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -131.88 -57.47 0.98 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.57 74.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 0.0 110.737 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -86.18 -33.54 20.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.359 0.599 . . . . 0.0 110.369 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 97' ' ' LEU . 7.8 tp -78.09 -21.54 50.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.994 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.581 HG21 ' O ' ' A' ' 114' ' ' LYS . 2.4 tp -82.77 -29.66 8.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.55 -31.02 21.46 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.71 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 tp -49.23 -45.1 44.1 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.07 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.541 ' CZ ' ' HG ' ' A' ' 101' ' ' LEU . 48.8 m-85 -62.63 81.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.368 . . . . 0.0 110.953 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -120.84 102.99 43.75 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.129 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -49.86 -25.8 12.63 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.434 2.089 . . . . 0.0 112.382 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -56.55 154.75 8.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -94.99 152.61 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.996 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -132.36 -99.92 0.76 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.46 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -142.59 -168.37 2.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 110.988 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.91 113.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.957 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 28.7 t -154.28 -48.06 0.09 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -110.16 163.17 13.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.102 179.975 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.519 -0.232 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.3 134.64 33.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.764 0.316 . . . . 0.0 110.984 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -121.81 -172.1 2.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.7 mtt -75.36 -77.09 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.88 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -94.68 157.27 16.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.821 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -148.01 134.27 19.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.967 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.417 HG22 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER -117.17 140.49 49.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.659 179.947 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.06 145.24 31.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.322 0.582 . . . . 0.0 112.535 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.5 p -92.75 126.52 37.87 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.95 153.59 11.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.459 -178.503 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.495 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.1 p -138.51 126.9 29.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 0.0 111.623 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.45 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 7.7 m -95.74 104.44 15.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.289 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -99.52 106.56 18.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.468 ' ND2' ' CE2' ' A' ' 20' ' ' TYR . 1.8 t30 -126.41 135.9 51.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.815 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.79 16.89 15.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.951 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.461 HG22 ' HG2' ' A' ' 17' ' ' LYS . 1.5 mt -59.9 -70.55 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.843 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.461 ' HG2' HG22 ' A' ' 16' ' ' ILE . 7.7 pttm -167.0 -173.77 2.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.902 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.433 ' HB2' ' CD2' ' A' ' 28' ' ' HIS . 15.8 pt-20 -96.0 -14.3 23.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.686 0.279 . . . . 0.0 111.526 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -105.57 54.6 0.59 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.422 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.493 ' CD2' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -117.25 13.33 14.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.758 0.313 . . . . 0.0 111.565 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 60.69 -175.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.33 0.586 . . . . 0.0 112.123 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.44 ' CD ' ' HB2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -173.53 -161.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.058 179.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -48.94 -26.81 2.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.014 0.435 . . . . 0.0 110.942 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 146.23 37.07 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.225 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.479 ' N ' ' CD1' ' A' ' 25' ' ' PHE . 0.9 OUTLIER -142.07 26.04 1.88 Allowed 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.38 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 42.1 53.93 4.2 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.905 0.383 . . . . 0.0 111.425 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.44 ' HB2' ' CD ' ' A' ' 22' ' ' ARG . 3.5 t80 -57.24 153.22 12.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.998 -179.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.433 ' CD2' ' HB2' ' A' ' 18' ' ' GLU . 9.6 m170 -103.15 172.61 6.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.12 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 74.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.888 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 28' ' ' HIS . . . -144.0 -143.47 4.07 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.425 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.45 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 3.5 p-10 -137.1 132.18 33.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.919 0.39 . . . . 0.0 111.454 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.495 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 13.6 t-20 -122.24 133.83 54.7 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.054 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.6 m -87.1 145.42 26.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 111.63 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.632 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.84 142.18 44.53 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.998 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.632 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.4 157.58 37.53 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.33 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.431 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.23 113.05 6.22 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.688 0.756 . . . . 0.0 111.155 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.417 ' CA ' HG22 ' A' ' 7' ' ' THR . 2.8 t -129.28 171.71 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.708 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.401 ' O ' ' CZ ' ' A' ' 8' ' ' PHE . 42.7 m -56.38 -72.55 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.16 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.5 -16.67 0.11 Allowed 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 p -46.21 -41.09 12.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.518 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.72 -28.56 63.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.416 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 10.6 tp -78.45 -50.59 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.0 110.8 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.53 -22.35 59.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.496 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -66.85 -44.56 80.71 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.934 0.397 . . . . 0.0 110.371 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.432 HD11 HG12 ' A' ' 10' ' ' VAL . 18.0 mt -78.88 -54.08 6.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.379 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 2.5 mttp -45.59 -28.75 1.02 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.469 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.82 -27.51 5.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.305 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.57 94.13 48.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.5 -21.27 18.08 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.733 2.289 . . . . 0.0 112.712 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.412 ' HB3' HD13 ' A' ' 51' ' ' LEU . 9.1 ttm180 -47.65 -39.7 17.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.49 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.493 HD12 ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -107.28 -165.22 1.04 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.519 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.59 140.75 48.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.747 0.308 . . . . 0.0 111.514 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.415 ' CG2' ' CD1' ' A' ' 45' ' ' LEU . 3.3 p -132.22 116.81 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.896 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.431 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.5 mt-30 -127.63 133.19 49.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.653 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.462 ' HA ' HG22 ' A' ' 10' ' ' VAL . 1.1 pt -93.93 130.67 42.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.966 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.0 p -122.36 104.67 9.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.785 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -156.11 -72.68 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.005 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.0 p 55.95 171.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.961 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 166.44 50.14 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.584 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.0 p -115.13 -59.76 1.97 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.346 . . . . 0.0 110.971 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.75 165.04 11.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.81 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -131.54 90.38 2.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.823 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 123.37 -58.4 0.63 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.45 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -110.11 166.21 12.43 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.482 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -97.91 136.43 38.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.797 0.332 . . . . 0.0 110.898 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -83.74 110.78 3.35 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.466 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -78.12 -71.5 0.42 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.896 0.379 . . . . 0.0 110.968 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 59.8 p -115.89 174.89 5.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.947 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -112.23 -60.26 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.793 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 62.42 84.48 0.19 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.031 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.61 -16.3 42.11 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.668 2.245 . . . . 0.0 112.498 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 75.56 91.06 0.08 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.076 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -142.29 -148.26 4.96 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.496 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.62 145.44 0.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 59.25 -177.59 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.912 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.474 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 0.0 OUTLIER 74.09 -60.84 0.51 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.086 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 76' ' ' GLU . 1.5 pm0 39.69 65.46 0.71 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.781 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.6 mtpp 61.95 -178.38 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.001 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 63.16 98.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.939 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 mp -98.14 -63.81 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 -149.35 102.15 3.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.848 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 61.19 76.89 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.054 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -141.23 105.17 6.06 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -68.45 111.12 2.44 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.342 2.028 . . . . 0.0 112.272 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.76 117.33 4.8 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.368 2.045 . . . . 0.0 112.289 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.2 m -73.12 -30.5 63.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.978 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.2 p -96.15 153.74 17.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -176.67 -40.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.945 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -82.04 -40.68 21.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.941 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -48.74 -35.87 15.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.698 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -62.23 -12.59 21.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.403 ' HB3' ' CD2' ' A' ' 97' ' ' LEU . 8.0 m-85 -80.73 -8.04 59.54 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.256 -0.278 . . . . 0.0 111.346 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.87 -162.17 0.19 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.779 0.323 . . . . 0.0 111.079 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.53 ' HA ' ' CD1' ' A' ' 97' ' ' LEU . 21.9 t -115.78 -42.72 3.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.21 0.529 . . . . 0.0 110.947 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -78.21 -19.71 53.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.121 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -27.53 54.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.0 110.675 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.854 HD23 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -76.35 -59.08 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.493 ' HG3' ' CZ ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -47.38 -34.93 7.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.741 177.711 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.94 -21.71 29.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.021 0.439 . . . . 0.0 111.737 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 4.1 mm-40 -86.65 -38.59 16.91 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.566 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.555 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 3.2 mt -59.84 -48.07 83.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.118 0.485 . . . . 0.0 109.964 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -39.03 91.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.48 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -6.57 58.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.3 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.414 ' HB3' ' CD1' ' A' ' 106' ' ' ILE . 2.1 ttt85 -100.12 -15.57 18.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.308 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 98.72 38.9 3.77 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.339 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 104' ' ' ARG . 4.2 mp -110.32 -22.01 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.793 0.296 . . . . 0.0 111.045 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.7 t 45.51 28.34 0.49 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.794 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.493 ' CZ ' ' HG3' ' A' ' 98' ' ' LYS . 90.2 m-85 51.24 -160.23 0.09 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.108 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.8 pttt 45.52 93.13 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.064 0.459 . . . . 0.0 111.322 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 179.0 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.618 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 179.18 42.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.765 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -145.22 147.67 32.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.201 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' THR . . . . . 0.419 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 52.5 p -139.72 -80.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.485 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.4 tttm -145.38 -57.12 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.74 0.305 . . . . 0.0 110.74 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.0 -22.18 33.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.088 0.471 . . . . 0.0 109.884 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -86.2 -38.22 17.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -74.5 -36.82 63.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.181 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.854 ' HA ' HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -62.67 -28.54 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.402 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.27 -33.0 19.41 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.918 0.39 . . . . 0.0 111.559 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.3 OUTLIER -59.43 -53.02 62.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.305 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.563 ' CE2' ' HB3' ' A' ' 97' ' ' LEU . 24.8 m-85 -43.55 90.55 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.939 0.399 . . . . 0.0 111.75 -178.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -174.98 115.25 0.29 Allowed Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.149 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.24 61.13 2.57 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.414 2.076 . . . . 0.0 112.254 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -179.62 175.9 0.84 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.964 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -177.62 173.87 1.59 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.893 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -142.9 -171.37 13.37 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -89.35 -26.76 20.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.739 0.304 . . . . 0.0 111.043 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.31 169.76 0.57 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.002 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.34 -65.37 1.02 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.891 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.89 163.02 28.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.87 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.102 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -86.52 125.61 33.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.812 0.339 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -99.14 -26.58 14.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.977 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 mmm 65.06 114.33 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.854 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.75 90.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -136.38 29.79 2.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.476 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 8.0 t -104.31 130.02 52.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.586 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.456 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -146.92 148.06 31.4 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.9 m -96.18 115.01 26.76 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.585 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.17 151.39 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-O 120.895 0.378 . . . . 0.0 111.59 -178.711 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.467 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.6 p -137.4 131.7 44.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.538 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 29.3 m -93.06 104.75 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.287 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.53 106.68 17.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.705 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -108.16 112.73 25.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.38 43.42 1.12 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.165 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.404 ' N ' ' CD1' ' A' ' 16' ' ' ILE . 3.2 mp -106.38 -61.5 2.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.385 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.51 -170.73 0.36 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.765 0.317 . . . . 0.0 111.094 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.412 ' HA ' ' N ' ' A' ' 29' ' ' LEU . 5.4 mm-40 -84.24 -7.78 59.24 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.655 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -136.18 80.38 0.3 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.81 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -130.48 23.94 5.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.82 0.343 . . . . 0.0 111.053 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 60.24 171.63 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.159 0.504 . . . . 0.0 111.492 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.462 ' CB ' ' HB2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -179.05 -84.62 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.29 178.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -101.69 15.88 27.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.936 0.398 . . . . 0.0 110.092 178.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.78 37.61 7.29 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.978 -0.629 . . . . 0.0 111.868 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -155.65 36.07 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 45.78 95.93 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.795 0.331 . . . . 0.0 111.464 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.462 ' HB2' ' CB ' ' A' ' 22' ' ' ARG . 10.9 t80 -77.42 138.98 39.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.049 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -70.09 176.51 3.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.769 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.412 ' N ' ' HA ' ' A' ' 18' ' ' GLU . 3.5 tm? -82.33 103.0 11.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.11 0.481 . . . . 0.0 110.644 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.27 -142.38 7.91 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.705 -0.679 . . . . 0.0 112.288 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.4 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 34.1 p-10 -138.44 139.16 38.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.963 0.411 . . . . 0.0 111.173 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 2.0 t-20 -113.88 125.08 53.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.061 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.0 145.43 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.434 0.635 . . . . 0.0 111.685 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.585 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -112.09 138.95 48.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.816 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.557 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.45 156.68 39.04 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.279 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.476 ' CB ' ' OG1' ' A' ' 7' ' ' THR . . . -70.46 108.4 4.26 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 111.426 -178.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.6 OUTLIER -128.21 -176.51 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.186 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.449 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 0.1 OUTLIER -48.82 -68.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.472 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.16 -17.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.5 t -42.42 -37.66 1.65 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.793 0.33 . . . . 0.0 111.687 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.577 ' CB ' ' HG ' ' A' ' 34' ' ' LEU . 2.3 pp0? -53.62 -50.46 65.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.456 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.32 -46.47 86.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.091 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.87 -33.09 68.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.301 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -44.31 93.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.943 0.402 . . . . 0.0 110.279 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.43 HD12 ' CG1' ' A' ' 10' ' ' VAL . 21.9 mt -78.74 -33.63 46.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.885 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.4 mttt -71.17 -22.58 62.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.132 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.09 -61.83 1.7 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.574 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.03 124.51 53.94 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.69 56.89 6.24 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.576 2.184 . . . . 0.0 112.418 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.69 -39.36 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.944 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.413 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -111.86 -173.1 2.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.446 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.454 ' O ' ' CG2' ' A' ' 52' ' ' VAL . 16.2 m -119.44 106.26 18.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.835 0.35 . . . . 0.0 111.881 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.5 p -99.87 106.19 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.172 0.51 . . . . 0.0 110.757 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.524 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -127.33 127.89 45.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.107 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.54 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.13 130.35 37.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.05 0.452 . . . . 0.0 111.455 -179.824 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.9 p -122.32 104.64 9.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.559 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -105.12 -60.48 1.61 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.018 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 t -129.17 -46.06 1.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.918 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 172.54 168.4 33.86 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.456 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.9 p -103.98 142.75 33.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.813 0.34 . . . . 0.0 110.982 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.84 175.68 9.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.914 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 60.36 29.76 19.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.875 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -93.63 -23.4 23.73 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.574 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 179.51 -35.85 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.531 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -91.02 50.41 1.78 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.849 0.357 . . . . 0.0 110.925 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -164.83 84.42 0.1 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.511 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -168.23 -177.38 3.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.825 0.345 . . . . 0.0 110.933 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.0 m -146.43 -48.11 0.2 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.895 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -101.24 129.86 47.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.867 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -154.7 157.1 32.04 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.883 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.56 -168.14 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.582 2.188 . . . . 0.0 112.309 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.07 80.64 3.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.073 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -103.98 108.23 3.14 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.548 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.26 126.63 24.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.925 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 60.22 32.03 20.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.89 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.86 85.67 2.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.799 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.75 8.61 30.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.311 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 mttt 61.91 -81.07 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.745 0.307 . . . . 0.0 111.002 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.38 138.95 50.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.863 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.54 -48.5 1.93 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -158.66 146.27 17.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.851 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -101.3 126.66 48.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.1 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.457 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 0.3 OUTLIER -168.22 -65.01 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.939 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 2.5 Cg_endo -42.63 -57.71 1.56 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.806 2.338 . . . . 0.0 112.628 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' A' ' 84' ' ' PRO . 55.7 Cg_endo -69.62 143.93 53.1 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.376 2.051 . . . . 0.0 112.316 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -171.34 -67.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.919 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.9 p -71.89 -178.04 2.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 67.42 -69.98 0.13 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.035 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -64.18 -15.92 60.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.386 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -48.62 -49.44 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.7 0.286 . . . . 0.0 111.221 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -10.1 10.3 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 3.7 m-85 -104.9 127.45 52.73 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.691 0.281 . . . . 0.0 110.655 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.3 -87.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.06 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.677 ' O ' ' CD2' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -151.83 -37.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-O 120.972 0.415 . . . . 0.0 111.047 179.855 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.63 -19.66 35.05 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.869 0.366 . . . . 0.0 110.99 178.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -77.91 -43.1 31.03 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.246 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.677 ' CD2' ' O ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -64.8 -55.84 17.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.868 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.465 ' CD ' ' O ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -50.89 -31.95 19.08 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.0 178.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.06 -25.26 27.71 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.122 0.487 . . . . 0.0 111.537 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 1.7 mt-30 -86.88 -43.59 12.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.888 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.495 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 8.8 mt -54.74 -46.75 74.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.465 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -39.07 88.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.855 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -15.85 63.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 101' ' ' LEU . 8.7 ptm180 -107.96 -15.23 14.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.047 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.59 83.9 0.47 Allowed Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.826 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.424 HG22 ' CD2' ' A' ' 101' ' ' LEU . 14.6 tt -125.84 -39.46 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.69 0.281 . . . . 0.0 111.524 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.413 ' N ' HG23 ' A' ' 106' ' ' ILE . 4.1 m 71.58 87.8 0.11 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.647 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -116.0 124.89 51.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.997 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -176.98 37.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -170.8 30.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.341 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 84.2 p 178.78 -76.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.749 0.309 . . . . 0.0 110.922 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.08 81.02 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.734 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -72.4 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.364 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.405 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -146.05 -57.44 0.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.491 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.28 67.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 11.8 mm-40 -85.91 -37.1 19.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.886 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -69.15 -40.85 77.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.828 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.538 ' HA ' ' HG ' ' A' ' 97' ' ' LEU . 0.9 OUTLIER -70.6 -30.5 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.47 ' N ' HG13 ' A' ' 118' ' ' ILE . . . -86.16 -31.83 21.6 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.34 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 1.1 mp -54.52 -42.75 71.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.323 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.495 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 1.9 m-85 -46.04 -28.09 1.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.601 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -47.34 131.37 9.98 Favored Pre-proline 0 CA--C 1.531 0.238 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.23 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -51.57 -41.77 59.19 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.448 2.099 . . . . 0.0 112.391 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -161.05 147.23 14.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -129.25 35.01 4.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -157.15 -44.12 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.513 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -135.47 126.45 27.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.844 0.354 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -176.33 151.14 0.97 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.873 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 60.29 -178.44 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.926 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -135.59 -47.25 0.68 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.922 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.148 -0.929 . . . . 0.0 111.146 179.905 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 t -91.57 163.24 14.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.819 0.342 . . . . 0.0 110.994 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 61.3 114.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.2 mtt -155.33 160.33 40.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -60.7 93.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.867 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -113.05 -29.79 7.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.038 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.494 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 12.5 t -138.57 130.7 28.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.962 0.41 . . . . 0.0 111.072 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.454 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -146.79 145.28 29.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.24 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.6 p -94.45 133.4 38.08 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.652 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.43 155.86 11.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 121.039 0.447 . . . . 0.0 111.569 -179.093 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.3 p -138.34 101.53 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.596 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.2 t -92.69 129.23 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.161 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.81 107.41 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.401 ' HB3' ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -128.22 144.22 51.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.909 0.385 . . . . 0.0 110.753 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -120.57 81.58 1.78 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.198 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.3 mt -129.65 -58.01 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.171 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.23 -18.07 0.91 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.715 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 65.63 23.13 11.67 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.138 0.494 . . . . 0.0 110.318 -179.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -178.07 57.61 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.497 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.421 ' CD1' ' O ' ' A' ' 20' ' ' TYR . 1.1 t80 -91.09 30.97 1.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.892 0.377 . . . . 0.0 111.352 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.02 -173.29 0.12 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.186 0.517 . . . . 0.0 111.817 178.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HG2' ' CD2' ' A' ' 27' ' ' PHE . 14.9 tpp180 -178.61 -33.73 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.927 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 170.69 -32.18 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.653 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 155.59 31.37 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.082 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -129.56 20.19 5.65 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.522 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.401 ' O ' ' CD2' ' A' ' 28' ' ' HIS . 0.4 OUTLIER 42.96 37.56 1.15 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.956 0.408 . . . . 0.0 110.93 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.446 ' CD2' ' HG2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -45.26 96.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.643 -179.336 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.401 ' CD2' ' O ' ' A' ' 26' ' ' SER . 14.2 m170 -60.94 124.5 20.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.537 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.401 ' HB3' ' HB3' ' A' ' 14' ' ' ASN . 17.3 mt -58.2 -32.41 68.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.116 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -55.64 -168.56 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.756 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -57.33 121.07 9.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 111.411 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.474 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 23.0 t-20 -143.64 123.66 13.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.4 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -86.85 145.58 26.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.398 0.618 . . . . 0.0 111.361 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.652 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -115.37 141.37 48.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.97 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.582 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.32 156.1 39.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.158 0.504 . . . . 0.0 110.555 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.494 ' CB ' ' OG1' ' A' ' 7' ' ' THR . . . -70.56 105.34 3.07 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.496 0.665 . . . . 0.0 111.715 -177.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.475 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.8 OUTLIER -122.31 -175.92 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.909 -179.674 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.414 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 0.2 OUTLIER -59.73 -63.91 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.558 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -173.43 -18.64 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.7 m -42.41 -32.1 0.49 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.991 0.424 . . . . 0.0 111.011 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.646 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.59 -61.64 2.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.548 179.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.471 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 7.3 tp -52.6 -52.83 53.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.71 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.42 -34.88 78.95 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.682 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.09 -52.52 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.909 0.385 . . . . 0.0 110.438 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.43 ' HB3' ' HB ' ' A' ' 53' ' ' VAL . 0.5 OUTLIER -78.71 -54.54 6.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.748 179.516 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -53.47 -24.05 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.304 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.26 -29.94 1.82 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 111.372 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -128.62 125.78 23.2 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 61.28 4.96 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.405 2.07 . . . . 0.0 112.366 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.437 ' HB2' HD23 ' A' ' 51' ' ' LEU . 20.8 mmt-85 -123.91 -39.69 2.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' A' ' 50' ' ' ARG . 0.0 OUTLIER -119.85 133.44 55.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.962 0.41 . . . . 0.0 110.971 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.2 t -68.87 107.21 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.768 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.43 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 2.1 p -103.4 115.26 45.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.938 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -127.07 144.9 50.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.833 -0.622 . . . . 0.0 112.165 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.552 ' HA ' HG22 ' A' ' 10' ' ' VAL . 1.9 pt -102.64 134.39 43.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.176 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.8 m -122.4 104.64 9.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -69.81 -70.57 0.28 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 67.8 p -144.42 -176.62 5.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.963 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -129.33 100.17 0.49 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.547 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.61 -27.03 58.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.784 0.326 . . . . 0.0 111.031 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -56.28 133.1 52.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.011 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 60.92 156.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -94.51 -37.58 5.27 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.503 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.87 152.22 6.36 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.539 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -174.77 39.08 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.833 0.349 . . . . 0.0 110.938 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -145.95 172.74 26.52 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.482 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.24 -41.07 6.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.749 0.309 . . . . 0.0 110.911 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 52.3 p 53.97 65.53 1.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.111 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -163.78 31.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.941 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.483 ' N ' ' HD2' ' A' ' 71' ' ' PRO . 5.0 tp10 -72.66 -50.09 7.86 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.225 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 70' ' ' GLU . 73.5 Cg_endo -74.98 136.61 20.67 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.283 1.989 . . . . 0.0 112.383 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.44 81.06 1.56 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.055 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 68.03 72.94 0.74 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.558 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.54 -59.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.808 0.337 . . . . 0.0 110.941 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.72 -42.37 67.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.912 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -70.34 -169.76 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.947 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 64.54 135.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.917 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -64.71 93.67 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.982 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -172.75 117.5 0.33 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.27 139.69 37.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 59.59 -179.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.966 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -144.17 159.63 42.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.995 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -166.39 63.05 0.77 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.814 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HG2' ' HD3' ' A' ' 85' ' ' PRO . 4.1 Cg_exo -39.17 -51.92 2.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.251 2.634 . . . . 0.0 112.751 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.439 ' HD3' ' HG2' ' A' ' 84' ' ' PRO . 87.9 Cg_exo -46.06 98.9 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.419 2.08 . . . . 0.0 112.425 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.4 m -59.24 -30.64 68.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.857 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.404 ' CB ' ' HB2' ' A' ' 90' ' ' ASN . 0.2 OUTLIER -151.05 -170.49 3.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.811 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.66 -30.57 7.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.811 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -117.24 -43.74 2.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.885 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.404 ' HB2' ' CB ' ' A' ' 87' ' ' THR . 1.9 m120 -48.97 -37.18 19.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.495 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 38.3 p -61.98 -15.21 42.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -94.23 133.8 37.37 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.804 0.335 . . . . 0.0 110.675 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 3.0 p -74.45 -94.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.359 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.402 ' HA ' HD13 ' A' ' 97' ' ' LEU . 1.4 m -164.41 -38.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.054 0.454 . . . . 0.0 110.79 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.75 -20.88 38.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.691 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -66.95 -52.23 45.45 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.349 0.595 . . . . 0.0 109.74 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.572 HD11 ' HG ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.92 -59.61 4.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.715 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.452 ' CE ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -44.65 -38.35 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.939 178.431 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.19 -21.92 28.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.048 0.452 . . . . 0.0 111.669 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 6.8 mm-40 -86.37 -47.81 9.02 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.09 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.451 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 5.5 mt -51.89 -48.3 64.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.164 0.506 . . . . 0.0 109.845 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.41 HG23 ' CE1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -62.12 -41.42 98.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.229 179.462 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.74 -6.96 50.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.106 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -105.81 -15.43 14.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 78.5 70.94 1.27 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.94 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 107' ' ' THR . 0.2 OUTLIER -128.26 -159.33 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.469 ' N ' ' CG2' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -140.45 116.11 10.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.838 0.351 . . . . 0.0 110.791 179.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.442 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 2.4 p90 -138.72 105.85 5.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.987 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -176.78 37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.783 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.52 -50.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 91.6 p -101.05 -63.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.432 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -70.61 64.79 0.3 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.07 0.462 . . . . 0.0 110.334 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -61.19 -75.14 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.346 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.468 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 1.5 ptmt -146.3 -57.46 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.718 0.294 . . . . 0.0 111.434 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.24 -23.01 64.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.863 0.363 . . . . 0.0 111.115 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.4 mm-40 -85.82 -36.29 20.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.855 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.572 ' HG ' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -74.48 -37.11 63.28 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.597 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.546 HG23 HD11 ' A' ' 97' ' ' LEU . 1.7 pp -64.72 -35.19 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.579 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.33 -28.26 23.79 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.891 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.01 -30.6 71.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.687 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.488 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.0 OUTLIER -61.37 82.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.721 0.296 . . . . 0.0 111.151 -179.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -125.23 74.91 68.06 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.303 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.98 124.66 12.97 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.682 2.254 . . . . 0.0 112.106 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -153.5 117.85 4.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.167 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.85 109.4 18.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.857 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -59.28 -92.57 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.653 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -150.89 -46.38 0.12 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.765 0.316 . . . . 0.0 111.06 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -123.73 79.96 1.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.818 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 63.6 p -81.96 160.26 23.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.935 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -102.81 165.22 11.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.875 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.092 179.995 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m 60.59 80.63 0.21 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.808 0.337 . . . . 0.0 110.938 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -87.36 -59.72 2.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.893 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.1 mtt -147.04 99.95 3.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.791 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -135.34 -49.61 0.73 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -150.06 158.17 43.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.017 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.412 HG23 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER -116.68 139.83 50.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.793 -179.989 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.489 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.22 144.09 30.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.43 0.633 . . . . 0.0 112.393 -179.522 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.4 p -95.1 121.83 37.14 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.81 151.53 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 111.355 -178.775 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.54 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.9 p -134.17 123.5 43.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.242 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.469 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 1.8 m -95.65 104.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.784 -179.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.43 106.89 19.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.896 178.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -96.3 117.09 30.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.24 0.543 . . . . 0.0 111.61 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.5 28.59 4.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.184 178.244 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.445 ' CG2' ' HG3' ' A' ' 17' ' ' LYS . 7.3 mt -83.78 -77.77 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.268 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.445 ' HG3' ' CG2' ' A' ' 16' ' ' ILE . 11.2 mtmt -155.26 -168.6 2.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.733 0.301 . . . . 0.0 110.844 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -102.41 28.03 6.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.556 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 176.96 58.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.288 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.426 ' CD2' HD13 ' A' ' 16' ' ' ILE . 9.4 t80 -99.66 19.52 15.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 0.0 110.921 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 62.14 174.57 0.13 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.316 0.579 . . . . 0.0 111.819 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.518 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -171.83 -79.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.862 179.001 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.96 -4.72 52.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.563 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.91 44.66 0.8 Allowed Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.972 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.492 ' O ' ' CB ' ' A' ' 26' ' ' SER . 0.8 OUTLIER -156.52 -56.03 0.09 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.454 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.492 ' CB ' ' O ' ' A' ' 25' ' ' PHE . 2.5 p 154.2 116.5 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.63 0.372 . . . . 0.0 110.179 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.518 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 38.0 t80 -87.79 -18.68 28.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.387 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 65.37 170.23 0.21 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.765 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 14.1 tp -90.65 105.75 18.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.561 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 177.06 -141.4 5.35 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.357 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.469 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 2.2 p30 -150.06 136.36 18.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.679 0.276 . . . . 0.0 111.201 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.54 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.2 t30 -116.74 131.94 56.82 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.291 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.02 145.54 26.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.536 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.61 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -113.75 140.61 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.19 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.59 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.29 157.5 37.59 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.202 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.431 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.4 112.74 6.14 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.734 0.778 . . . . 0.0 111.2 -177.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.412 ' CA ' HG23 ' A' ' 7' ' ' THR . 3.5 t -128.35 168.82 20.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 CA-C-N 114.463 -1.244 . . . . 0.0 110.584 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.2 m -55.3 -61.25 2.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.273 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -164.91 -16.76 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.0 p -43.62 -33.67 1.25 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.501 ' CD ' ' N ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -65.79 -37.43 86.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.799 0.333 . . . . 0.0 111.749 -179.61 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.501 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.2 tp -68.31 -38.75 81.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.86 -28.99 22.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.276 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -47.93 81.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.874 0.369 . . . . 0.0 110.378 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.478 ' HB3' ' HB ' ' A' ' 53' ' ' VAL . 1.9 mp -79.02 -41.53 28.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -73.27 -12.74 60.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.299 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -50.81 -33.29 22.92 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.822 0.344 . . . . 0.0 111.295 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 p-10 -121.66 129.83 25.03 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.83 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -77.09 70.82 6.52 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.5 2.134 . . . . 0.0 112.272 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.4 ' HD3' ' CZ ' ' A' ' 20' ' ' TYR . 2.0 mtt85 -131.8 -56.01 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.886 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.506 ' N ' ' CD1' ' A' ' 51' ' ' LEU . 2.8 mp -100.51 170.46 8.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.628 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.9 t -105.58 107.39 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.608 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.478 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 1.5 p -101.18 114.57 40.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.29 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.535 ' O ' HG21 ' A' ' 10' ' ' VAL . 0.8 OUTLIER -127.12 125.93 42.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.454 -179.232 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.515 ' HA ' HG21 ' A' ' 10' ' ' VAL . 2.6 pp -88.19 145.79 7.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.289 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 44.3 p -121.99 104.61 9.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.644 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -59.56 -76.73 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.016 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 p -108.53 111.01 22.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.977 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -115.17 27.49 8.52 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.472 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 t -108.88 -32.35 7.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.828 0.347 . . . . 0.0 110.892 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.91 97.94 2.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.88 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 61.43 92.37 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.783 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -97.3 -160.15 31.28 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.579 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -130.3 -173.92 13.53 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.454 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -105.42 -31.32 9.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.855 0.359 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 114.28 137.27 6.48 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.59 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.5 mt -148.08 40.81 0.98 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.862 0.363 . . . . 0.0 110.856 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.41 139.63 31.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.946 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -114.35 128.64 56.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.912 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -87.88 -53.8 0.37 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.889 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -51.43 -40.37 62.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.532 2.155 . . . . 0.0 112.237 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.71 150.21 32.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.024 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 164.63 -83.3 0.11 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.502 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 p -174.46 128.59 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.94 0.4 . . . . 0.0 110.842 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -152.18 133.82 14.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 63.32 -81.33 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.953 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.01 -174.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.028 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.0 tttt -80.35 117.88 21.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.933 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -157.13 131.96 8.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.3 mp -105.57 150.01 25.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.854 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.7 tpt85 -160.74 -69.14 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.988 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.38 113.24 3.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.076 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.413 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 2.5 m-20 -79.98 -61.61 0.44 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.066 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.413 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 73.2 Cg_endo -76.03 123.31 7.22 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.503 2.135 . . . . 0.0 112.327 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.35 -62.24 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.396 2.064 . . . . 0.0 112.234 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.1 m -133.67 102.58 5.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.784 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.8 p -138.24 60.5 1.62 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 59.8 163.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.5 tp 75.47 -56.36 0.61 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.217 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.8 m-20 -48.78 -45.63 40.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.428 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.3 p -62.09 -14.55 37.63 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -84.09 143.82 29.46 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.684 0.278 . . . . 0.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 69.9 p -110.63 -88.23 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.588 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.6 t -154.56 -43.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -80.3 -20.84 43.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.081 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.1 -49.58 42.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 0.0 110.19 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.572 ' HA ' ' CE2' ' A' ' 121' ' ' PHE . 0.0 OUTLIER -56.02 -58.56 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.528 179.557 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -55.63 -34.67 65.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.087 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.02 -21.64 29.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.056 0.455 . . . . 0.0 111.573 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.466 ' N ' ' O ' ' A' ' 96' ' ' GLN . 3.5 mm-40 -86.53 -41.09 14.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.302 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.555 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 12.9 mt -56.14 -49.91 72.61 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.315 0.579 . . . . 0.0 109.754 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.11 -38.96 92.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.324 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.65 -6.84 53.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.957 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.3 mtt180 -100.36 -15.32 18.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.858 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.96 47.58 4.97 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.838 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.2 tt -140.43 95.91 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.822 0.344 . . . . 0.0 111.064 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.03 122.94 9.33 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.951 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.41 ' HB2' ' CB ' ' A' ' 112' ' ' ALA . 13.7 p90 -121.56 28.02 7.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.131 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -29.34 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.852 0.358 . . . . 0.0 110.77 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -124.98 150.97 46.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.855 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.15 26.34 13.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.41 ' CB ' ' HB2' ' A' ' 108' ' ' PHE . . . -148.53 103.99 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.18 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.3 p -98.92 -79.38 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.725 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.67 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 20.4 tttt -158.4 -39.5 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.087 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.7 -20.44 33.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.028 0.442 . . . . 0.0 110.224 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -85.59 -39.08 17.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.756 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.67 ' CD2' ' HA ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -78.31 -19.55 53.31 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.153 -179.771 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.639 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -80.79 -28.39 11.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 120.566 -0.453 . . . . 0.0 109.974 178.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.09 -33.12 19.59 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.133 0.492 . . . . 0.0 111.106 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.5 OUTLIER -54.18 -42.76 70.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.269 -178.911 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 30.7 m-85 -59.27 83.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.917 0.389 . . . . 0.0 111.305 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -164.15 87.71 1.14 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.126 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -50.07 -46.55 27.7 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.591 2.194 . . . . 0.0 112.381 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 58.31 105.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.183 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.65 30.31 3.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.92 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 94.27 75.58 1.29 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.522 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -132.5 -178.11 4.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.798 0.332 . . . . 0.0 110.916 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt -60.33 145.68 46.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.888 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.12 155.49 22.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.813 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -121.0 40.54 3.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.965 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.081 179.987 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.105 0 N-CA-C 112.546 -0.222 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -157.83 33.75 0.26 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.757 0.313 . . . . 0.0 110.853 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.7 p-80 -107.63 -43.69 4.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.851 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 17.4 mtt -132.89 156.86 46.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.968 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -101.07 128.21 47.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.942 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.56 59.72 1.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.712 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.426 HG21 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER -129.47 140.08 51.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.821 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.501 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.17 143.81 30.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.434 0.635 . . . . 0.0 112.632 -179.659 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 24.4 p -95.55 121.4 37.2 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.598 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.73 150.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.003 0.43 . . . . 0.0 111.282 -178.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.4 p -134.06 120.58 35.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.259 0.552 . . . . 0.0 111.522 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.442 ' O ' HG21 ' A' ' 12' ' ' VAL . 11.5 m -94.17 104.53 15.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.382 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -98.63 105.28 17.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.419 . . . . 0.0 110.15 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.466 ' ND2' ' HA ' ' A' ' 51' ' ' LEU . 13.1 m120 -137.98 146.9 43.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.065 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -145.94 74.43 1.38 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.77 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.2 mt -101.22 -50.59 10.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.235 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -143.35 -99.36 0.12 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.013 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 168.43 43.51 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.183 0.516 . . . . 0.0 110.111 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 149.28 66.05 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.404 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.459 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 15.9 t80 -111.82 59.23 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.003 0.43 . . . . 0.0 111.221 -179.013 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 33.68 83.83 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.439 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.54 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -85.34 54.27 3.05 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.647 179.38 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.54 ' CB ' ' O ' ' A' ' 22' ' ' ARG . . . 93.13 -24.1 0.05 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.462 0.305 . . . . 0.0 111.161 -179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 152.22 -23.5 0.87 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.125 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -82.44 -2.14 52.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.691 0.281 . . . . 0.0 110.796 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 46.09 78.62 0.06 Allowed 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.43 0.633 . . . . 0.0 110.84 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.492 ' HB2' ' CB ' ' A' ' 22' ' ' ARG . 8.2 t80 -68.81 150.23 48.07 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.725 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -82.17 15.8 2.23 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 47.89 79.42 0.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.283 0.563 . . . . 0.0 111.27 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.438 ' HA2' ' O ' ' A' ' 14' ' ' ASN . . . -152.36 -135.18 2.18 Favored Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.473 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.63 116.14 24.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.758 0.314 . . . . 0.0 110.735 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.422 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 17.9 t30 -129.94 131.04 45.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.943 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.14 145.48 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.302 0.572 . . . . 0.0 111.121 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -111.72 140.46 46.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.26 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.572 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.26 157.63 37.35 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.11 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.436 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.6 112.13 5.88 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.685 0.755 . . . . 0.0 111.287 -177.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.426 ' CA ' HG21 ' A' ' 7' ' ' THR . 4.1 t -127.77 168.26 21.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.088 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.656 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.7 t -55.09 -58.85 5.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.397 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -167.91 -17.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.5 m -43.43 -33.25 1.03 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.549 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -66.52 -41.45 88.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.829 0.347 . . . . 0.0 111.837 -179.551 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.478 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 4.8 tp -66.77 -34.36 77.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.501 -178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -91.94 -30.71 15.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.632 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.31 -42.42 88.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.947 0.403 . . . . 0.0 110.41 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.434 ' CD1' HG13 ' A' ' 12' ' ' VAL . 63.0 mt -79.04 -47.22 16.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.925 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -17.82 47.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.438 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.13 -39.87 6.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.801 0.334 . . . . 0.0 111.65 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.1 121.56 58.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -84.17 49.42 2.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.677 2.252 . . . . 0.0 112.774 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.23 -38.1 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.272 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.466 ' HA ' ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -93.55 -165.59 1.36 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.426 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.3 m -132.56 133.0 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 45' ' ' LEU . 1.6 p -131.83 112.83 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.021 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.544 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.4 OUTLIER -127.66 126.21 41.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.837 -178.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.503 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.4 pp -88.11 126.66 41.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.042 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.1 p -122.21 104.55 9.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.62 -62.22 1.28 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.908 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 t -117.57 105.99 12.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.867 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.82 120.12 10.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.475 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -169.91 69.27 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.876 0.369 . . . . 0.0 110.859 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -164.2 89.24 0.54 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -98.55 30.66 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.901 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -135.12 154.18 21.48 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -172.91 127.12 1.33 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.52 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.78 -31.1 15.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.869 0.366 . . . . 0.0 110.851 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 137.02 -131.85 5.76 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.551 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mp -130.43 -175.58 3.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.821 0.343 . . . . 0.0 110.851 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -170.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.946 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.9 mttt -59.97 171.26 0.99 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -151.08 148.64 23.12 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.828 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.62 62.57 2.95 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.548 2.165 . . . . 0.0 112.323 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.76 142.15 29.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.071 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -140.97 54.67 0.63 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.483 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 64.47 -78.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.77 0.319 . . . . 0.0 110.98 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -137.62 177.63 7.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.902 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 60.29 81.99 0.17 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.885 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -130.97 -48.05 1.02 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.946 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 mttt 60.81 157.04 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -179.2 -37.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.0 mt -53.87 128.17 29.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.052 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -122.13 30.36 6.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.98 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -128.18 154.95 45.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.978 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.56 106.25 0.64 Allowed Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.063 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -62.69 155.4 59.31 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.511 2.141 . . . . 0.0 112.214 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.07 61.33 3.94 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.506 2.137 . . . . 0.0 112.173 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.9 m -151.26 150.64 30.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 65.1 m 58.96 -86.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.911 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 58.52 38.49 25.43 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.804 0.335 . . . . 0.0 110.915 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -111.82 -17.67 12.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.431 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -49.07 -50.12 38.27 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.726 0.298 . . . . 0.0 111.132 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -13.05 25.9 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -94.84 122.82 37.86 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.643 0.259 . . . . 0.0 110.6 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 15.9 p -117.98 -95.49 0.48 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.349 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.58 ' HA ' HD21 ' A' ' 97' ' ' LEU . 3.4 m -138.2 -34.87 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.89 0.376 . . . . 0.0 111.438 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -82.78 -20.41 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.283 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -38.22 21.98 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.58 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -76.3 -49.21 17.56 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.024 -0.671 . . . . 0.0 109.717 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.46 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.9 OUTLIER -56.44 -33.75 66.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.696 178.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.18 -25.76 27.21 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 111.973 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 3.5 mt-30 -86.68 -42.82 13.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.014 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.442 ' HB3' HG21 ' A' ' 106' ' ' ILE . 6.6 mt -54.48 -48.1 72.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.087 0.47 . . . . 0.0 110.385 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -39.64 92.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.062 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -6.85 52.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -106.17 -15.22 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.047 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.89 68.4 1.56 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.774 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.501 ' CG1' ' H ' ' A' ' 107' ' ' THR . 0.4 OUTLIER -119.28 -146.74 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.501 ' H ' ' CG1' ' A' ' 106' ' ' ILE . 4.8 t -150.78 105.11 3.24 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 122.169 -0.332 . . . . 0.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.402 ' CG ' ' O ' ' A' ' 108' ' ' PHE . 2.8 p90 -142.92 66.28 1.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.948 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.35 -31.14 7.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.48 62.11 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.045 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 179.35 -38.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.024 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.49 108.31 17.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.017 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.75 -74.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.308 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.504 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.2 OUTLIER -144.83 -43.89 0.24 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -78.78 -24.31 44.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.929 0.395 . . . . 0.0 110.569 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -85.94 -36.5 19.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.563 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.525 HD22 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -80.04 -19.71 46.97 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.204 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.527 ' HA ' ' HG ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -83.73 -27.01 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.99 -34.55 19.22 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.764 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.5 tp -51.57 -44.4 62.73 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.472 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.447 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 4.9 m-85 -54.75 -23.46 17.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -52.82 154.45 4.94 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.224 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.6 105.7 0.8 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.519 2.146 . . . . 0.0 112.293 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -160.66 90.69 0.87 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.045 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.69 91.15 4.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.97 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -112.36 -78.13 0.88 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.475 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -120.58 175.99 5.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.763 0.316 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.92 130.79 1.57 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.867 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 1.4 m -151.29 -178.18 6.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.87 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -72.2 -72.86 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.94 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.283 -0.865 . . . . 0.0 111.088 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 N-CA-C 112.429 -0.268 . . . . 0.0 112.429 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.31 -52.01 0.88 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.856 0.36 . . . . 0.0 110.91 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -99.49 31.44 3.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.93 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.95 138.98 48.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.825 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.6 167.86 14.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.943 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.4 mttp -121.4 85.73 2.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.939 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.468 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 5.6 t -134.45 129.86 35.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.761 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.53 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.08 152.25 38.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.098 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 2.6 m -92.4 124.96 36.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.654 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -110.12 151.18 12.41 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 111.659 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -138.01 132.9 43.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.368 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 28.0 m -101.97 104.71 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.795 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.419 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -101.34 106.59 17.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.006 179.01 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -125.77 145.79 50.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.253 0.549 . . . . 0.0 111.671 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.42 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.0 OUTLIER -126.97 74.98 1.54 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.46 178.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.31 115.23 5.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.708 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.3 ptpt 39.57 -162.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.935 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -138.32 10.05 2.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.015 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -97.14 -28.94 8.27 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.07 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.16 98.81 0.04 OUTLIER 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.377 0.608 . . . . 0.0 109.723 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.47 ' HA ' ' C ' ' A' ' 26' ' ' SER . 17.6 ptt180 -155.65 150.47 26.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.593 -177.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 26' ' ' SER . 0.0 OUTLIER 171.7 -169.46 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.011 0.434 . . . . 0.0 111.77 179.381 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.12 66.38 7.68 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.331 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.411 ' HA2' ' CZ ' ' A' ' 27' ' ' PHE . . . 95.53 -20.15 50.95 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.481 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -75.05 -24.91 58.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.65 0.262 . . . . 0.0 111.139 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.531 ' O ' ' CD1' ' A' ' 27' ' ' PHE . 72.1 p -176.4 160.95 2.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.823 0.344 . . . . 0.0 111.236 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD1' ' O ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -157.03 153.18 27.54 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.23 179.194 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -41.91 142.86 0.62 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.145 0.498 . . . . 0.0 111.582 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.439 ' O ' ' CG ' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -52.3 91.05 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.156 179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -156.7 -146.97 4.62 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.417 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.419 ' HB3' ' CG ' ' A' ' 13' ' ' GLN . 3.5 p-10 -141.25 128.14 20.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.038 0.447 . . . . 0.0 111.265 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.418 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 16.2 m-20 -126.71 127.53 45.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.956 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.7 m -86.96 145.32 26.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.422 0.63 . . . . 0.0 111.739 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.654 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.7 OUTLIER -111.51 138.22 48.32 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.698 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.542 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.48 156.41 39.41 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.923 0.392 . . . . 0.0 110.192 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -70.72 109.96 5.24 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.431 0.634 . . . . 0.0 111.723 -177.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.6 OUTLIER -128.78 -177.01 1.74 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.039 -179.654 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.434 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 1.7 t -51.13 -64.85 0.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.366 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -177.75 -16.59 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.25 -34.47 0.78 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.574 ' CB ' ' HG ' ' A' ' 34' ' ' LEU . 1.4 pp0? -57.25 -49.87 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 0.0 111.232 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -56.14 -53.66 54.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.088 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.19 -27.0 64.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.216 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -64.5 -51.85 60.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.86 0.362 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.427 ' CB ' ' HB ' ' A' ' 53' ' ' VAL . 3.2 mm? -78.51 -32.18 47.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.088 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -75.11 -29.6 60.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.156 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.12 -62.84 1.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.6 120.43 81.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.83 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.41 59.91 6.85 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.514 2.142 . . . . 0.0 112.41 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -115.91 -64.54 1.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.982 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.99 -176.82 3.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.566 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.1 m -103.55 146.37 11.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.774 0.321 . . . . 0.0 111.782 -179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.427 ' HB ' ' CB ' ' A' ' 45' ' ' LEU . 4.8 p -126.66 116.72 45.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.805 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -127.41 139.54 52.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.336 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.521 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -95.11 117.66 39.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.36 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.5 p -122.31 104.62 9.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.68 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.61 -65.94 0.57 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.975 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.45 -176.98 0.11 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.899 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -123.4 165.7 16.05 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.477 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 m -176.67 119.68 0.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.852 0.358 . . . . 0.0 110.866 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.04 -65.78 0.97 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.847 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -138.62 31.63 2.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.932 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 60.1 -139.8 48.22 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.462 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.28 -39.93 1.85 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.504 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.91 124.66 30.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.825 0.345 . . . . 0.0 110.887 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.04 28.16 3.98 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.45 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 pp -153.83 160.32 42.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.819 0.342 . . . . 0.0 110.848 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.55 -68.09 0.19 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.872 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.1 mttp -114.25 110.16 19.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.882 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.424 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER 179.28 -53.4 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.896 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.424 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 34.7 Cg_exo -57.61 -161.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.516 2.144 . . . . 0.0 112.243 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -91.9 175.96 6.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.069 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -96.67 137.56 13.41 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.41 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.5 p -107.98 179.37 4.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.793 0.33 . . . . 0.0 110.93 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -171.47 163.31 6.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.925 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 63.47 15.81 9.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.46 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 176.89 -179.48 0.19 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.824 0.345 . . . . 0.0 110.931 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mtpp -139.87 84.38 1.97 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.733 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -140.05 159.21 42.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -92.34 139.91 30.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.915 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.0 mtp85 61.79 148.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.937 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -173.03 35.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -96.37 133.21 25.18 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.749 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.99 111.65 3.38 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.494 2.129 . . . . 0.0 112.351 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -56.43 -24.81 54.43 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.472 2.115 . . . . 0.0 112.27 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.1 m 63.34 -79.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.983 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -146.04 99.14 3.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.928 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -165.51 -45.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.819 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.411 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 3.1 mm? -91.4 -32.44 15.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -48.93 -43.65 39.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.633 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.0 m -61.99 -14.19 32.88 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.533 ' CD1' ' CE2' ' A' ' 121' ' ' PHE . 24.0 m-85 -114.13 104.8 12.48 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.819 0.343 . . . . 0.0 110.644 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.48 -86.58 0.12 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.164 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.581 ' HA ' HD21 ' A' ' 97' ' ' LEU . 11.3 t -148.25 -56.61 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.775 0.321 . . . . 0.0 111.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.44 -20.18 61.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.963 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -20.88 42.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.124 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.64 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -78.4 -58.56 3.19 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.401 -179.619 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.432 ' HB2' ' CZ ' ' A' ' 108' ' ' PHE . 2.3 ptpt -62.14 -25.68 67.88 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.274 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.76 -29.55 25.38 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.021 0.438 . . . . 0.0 112.164 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 29.0 mt-30 -86.72 -29.4 22.43 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.738 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.41 ' CD2' ' HB ' ' A' ' 106' ' ' ILE . 6.0 mt -67.05 -46.29 74.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.22 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.988 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.97 -6.81 49.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.087 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.3 mtt-85 -106.44 -15.3 14.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.957 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.93 64.45 1.42 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.841 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.41 ' HB ' ' CD2' ' A' ' 101' ' ' LEU . 18.1 mt -151.16 100.49 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.66 0.267 . . . . 0.0 111.167 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -57.18 122.25 12.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.84 0.352 . . . . 0.0 110.921 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 98' ' ' LYS . 13.8 p90 -130.56 5.54 4.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.547 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -99.14 31.48 3.03 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 0.0 110.91 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.38 25.97 0.6 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.5 p 177.19 -37.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.914 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -82.99 175.89 9.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.3 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 25.0 p -150.55 -80.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.496 ' HA ' HD23 ' A' ' 117' ' ' LEU . 2.5 pttt -145.35 -46.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.458 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.59 -25.2 41.6 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 0.0 110.264 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.14 -36.73 19.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.401 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.63 HD21 HD23 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -79.7 -19.42 48.96 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.054 -179.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.624 ' HB ' HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -83.74 -30.18 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 120.874 0.369 . . . . 0.0 110.268 178.502 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.83 -32.38 19.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.286 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.508 ' O ' ' C ' ' A' ' 121' ' ' PHE . 1.5 pp -72.5 -17.11 61.77 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.612 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -20.46 91.18 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.405 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . 64.35 86.55 0.14 Allowed Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.137 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.66 61.25 4.45 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.551 2.167 . . . . 0.0 112.328 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 67.58 -71.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.092 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -78.32 146.36 34.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 116.88 105.99 2.42 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.541 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -141.72 -49.44 0.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.9 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -170.15 158.3 6.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.9 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 37.8 m -133.9 150.31 51.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -139.02 36.24 2.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.892 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.094 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.527 -0.229 . . . . 0.0 112.527 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.9 t -75.48 -67.73 0.63 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.84 0.352 . . . . 0.0 110.913 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -163.91 93.18 0.71 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -80.85 137.96 36.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.768 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -174.45 -40.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.081 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.53 76.86 3.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.119 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.48 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 9.5 t -162.16 130.03 4.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.647 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.07 146.03 29.85 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.4 m -94.63 115.86 28.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.58 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.27 151.74 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.131 0.491 . . . . 0.0 112.061 -178.312 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.552 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.3 p -138.08 128.2 35.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.151 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 23.4 m -96.78 104.81 16.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.921 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.94 106.53 18.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.024 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -105.47 121.95 45.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.089 0.471 . . . . 0.0 112.185 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -105.49 25.91 10.14 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.1 mt -87.27 -60.13 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.576 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.1 pttt -176.71 -172.62 0.45 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.669 0.271 . . . . 0.0 111.111 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.401 ' HB3' ' HB2' ' A' ' 29' ' ' LEU . 12.2 pt-20 -113.57 13.33 18.74 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.952 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.61 -20.44 10.12 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.373 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.482 ' O ' ' HB2' ' A' ' 27' ' ' PHE . 2.0 t80 -69.05 99.05 1.04 Allowed 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.198 0.523 . . . . 0.0 109.833 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 27.9 ptt180 -176.36 -178.18 0.93 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.713 -178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.477 ' HB2' ' HB2' ' A' ' 26' ' ' SER . 0.6 OUTLIER -76.73 -50.59 13.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.046 0.45 . . . . 0.0 110.225 179.42 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -178.04 34.85 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.577 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 93.73 15.66 48.65 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.254 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.75 44.08 1.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.934 0.397 . . . . 0.0 110.627 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -160.1 -38.3 0.05 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.518 -179.776 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.482 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 71.8 m-85 -156.03 159.05 38.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.028 0.442 . . . . 0.0 111.668 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.421 ' CG ' ' O ' ' A' ' 27' ' ' PHE . 22.0 m-70 -160.23 173.67 15.38 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.365 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.401 ' HB2' ' HB3' ' A' ' 18' ' ' GLU . 21.4 tp -75.9 99.92 4.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.001 0.429 . . . . 0.0 110.66 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.57 -139.9 6.48 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.234 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.411 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -136.45 122.86 20.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.005 0.431 . . . . 0.0 111.114 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.552 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.0 t30 -107.1 122.0 45.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.871 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.1 p -86.7 145.45 26.68 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.538 0.685 . . . . 0.0 111.544 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.596 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -117.2 139.12 51.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.25 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.596 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.85 156.93 38.96 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 120.825 0.345 . . . . 0.0 110.102 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.48 ' CB ' ' OG1' ' A' ' 7' ' ' THR . . . -70.23 107.07 3.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.474 0.654 . . . . 0.0 111.544 -177.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.466 ' CG2' ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -124.66 -175.91 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.296 -179.401 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.466 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 16.4 m -51.68 -68.02 0.2 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.528 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -176.1 -21.43 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.4 -35.23 0.97 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.882 0.372 . . . . 0.0 111.478 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.561 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.22 -39.03 69.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.52 179.81 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.439 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 6.1 tp -70.58 -39.67 73.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.775 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.47 -27.37 56.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.53 -45.02 66.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.009 0.433 . . . . 0.0 110.491 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.417 HD13 ' CG1' ' A' ' 10' ' ' VAL . 51.4 mt -78.7 -30.6 46.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.014 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -69.84 -19.65 63.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.224 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.14 -55.01 27.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.38 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.41 118.65 64.38 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.999 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -81.85 54.7 5.17 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.632 2.221 . . . . 0.0 112.394 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.409 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 3.4 tpt180 -149.14 -63.28 0.23 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.719 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.66 175.93 0.99 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.489 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.4 m -120.55 123.06 69.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.0 p -116.9 106.28 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 0.0 110.299 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.569 ' O ' HG22 ' A' ' 10' ' ' VAL . 5.0 mt-30 -127.48 131.21 50.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.021 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.533 ' HA ' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.07 119.24 35.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.264 0.554 . . . . 0.0 111.622 -179.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 p -122.79 104.61 9.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.466 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 59' ' ' GLY . 6.4 tt0 -74.4 61.5 0.92 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.036 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.7 m 63.92 -74.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.116 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' A' ' 57' ' ' GLU . . . 134.41 84.79 0.22 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.278 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.4 m 63.46 117.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.739 0.304 . . . . 0.0 110.701 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 61.89 150.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.881 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -119.8 167.75 11.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.898 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 111.37 -109.61 2.56 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.46 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -127.03 145.95 16.07 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.528 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -135.03 36.13 3.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.863 0.363 . . . . 0.0 110.889 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 152.14 109.11 0.4 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.527 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -88.41 -72.94 0.51 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.813 0.34 . . . . 0.0 110.811 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.6 m -93.67 146.92 23.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.05 122.68 1.59 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.962 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -166.84 166.19 8.9 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.852 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -83.81 42.69 1.26 Allowed 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.101 2.534 . . . . 0.0 112.703 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 54.15 101.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.821 0.343 . . . . 0.0 111.372 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.05 80.69 0.82 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.456 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 t -111.26 -57.41 2.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.749 0.309 . . . . 0.0 110.917 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.35 -175.58 3.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -99.38 -75.99 0.55 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.4 -40.39 2.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.969 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? 63.43 41.18 7.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.86 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -155.65 -173.92 4.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.855 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 46.11 -169.34 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.364 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.17 173.45 6.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -154.84 152.32 29.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.122 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.03 136.82 22.2 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.771 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.463 ' N ' ' CD ' ' A' ' 85' ' ' PRO . 31.8 Cg_exo -57.72 -46.76 24.64 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.261 1.974 . . . . 0.0 112.428 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 84' ' ' PRO . 42.3 Cg_exo -56.65 -38.68 95.08 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.394 2.063 . . . . 0.0 112.255 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.6 m -94.19 169.04 10.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.978 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.9 t -178.47 -39.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.705 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.401 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 18.4 p30 -166.89 151.51 7.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.669 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.401 ' CB ' ' O ' ' A' ' 88' ' ' ASP . 0.6 OUTLIER 80.26 -49.48 0.34 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -48.86 -47.34 42.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.475 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.9 p -62.14 -12.78 21.52 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -115.46 122.43 45.73 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.674 0.273 . . . . 0.0 110.435 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.427 ' N ' HD13 ' A' ' 97' ' ' LEU . 93.5 m -84.75 -98.69 0.06 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.48 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.765 ' HA ' HD22 ' A' ' 97' ' ' LEU . 43.3 t -142.31 -56.84 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.075 0 CA-C-O 120.816 0.341 . . . . 0.0 111.361 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.25 -20.13 61.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.819 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.52 -21.18 38.76 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.083 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.765 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -75.35 -58.74 3.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.357 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.8 ptpt -57.82 -26.9 62.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.95 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.09 29.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.044 0.45 . . . . 0.0 111.663 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -86.79 -38.28 17.02 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 22.8 mt -63.83 -42.64 97.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.662 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.7 p -65.73 -40.82 92.56 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.113 0.482 . . . . 0.0 109.907 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -6.91 50.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.348 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 36.6 mtt180 -106.03 -15.27 14.94 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.158 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.35 42.25 5.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.598 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 23.4 mm -128.41 92.27 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.714 0.293 . . . . 0.0 111.201 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 p -57.75 151.13 18.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.847 0.356 . . . . 0.0 110.864 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.449 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 2.3 p90 -153.5 36.66 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.017 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -45.41 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -134.72 24.47 3.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.005 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 -33.58 4.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.993 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.402 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -139.67 119.64 13.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.142 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 68.6 p -92.21 -73.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.158 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.561 ' HA ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -145.25 -40.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -24.05 32.77 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.5 mm-40 -86.08 -38.46 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.434 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.564 HD21 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -76.25 -19.91 57.9 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.587 -0.278 . . . . 0.0 111.213 -179.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.564 ' N ' HD21 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.6 -33.17 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.249 -0.58 . . . . 0.0 109.582 177.927 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.43 -28.28 22.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.462 ' O ' ' N ' ' A' ' 122' ' ' ALA . 18.5 tp -48.77 -43.79 38.17 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.252 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.527 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 9.2 m-85 -45.42 90.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.535 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.462 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -116.24 154.71 48.76 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.973 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -65.22 -177.57 0.66 Allowed 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.564 2.176 . . . . 0.0 112.198 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -58.44 111.69 1.32 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.058 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -114.16 -179.95 3.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.875 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 133.27 -172.14 21.6 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.589 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -125.43 64.95 1.16 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.869 0.366 . . . . 0.0 110.946 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.1 mttt 60.07 159.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 66.47 -73.47 0.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.936 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 63.44 99.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.87 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.316 -0.85 . . . . 0.0 111.104 179.983 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.528 -0.229 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -130.15 93.98 3.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.869 0.366 . . . . 0.0 110.841 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.4 m-70 -119.85 -40.92 2.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.954 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -159.76 -44.54 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.895 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -84.77 151.75 24.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.021 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 48.8 tttm -176.81 38.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.72 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER -158.8 139.43 12.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.695 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.517 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.81 145.68 31.76 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.8 p -94.12 133.15 37.92 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.586 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.98 148.3 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.522 0.677 . . . . 0.0 111.85 -178.935 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.9 p -138.15 101.18 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.958 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.414 HG21 ' CD1' ' A' ' 45' ' ' LEU . 78.9 t -92.6 136.71 24.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.196 -178.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -119.3 112.45 19.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.572 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 141.56 29.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.05 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -141.09 31.52 1.76 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.385 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 mp -99.65 -59.61 3.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.178 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.75 179.15 8.77 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.51 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -109.2 2.5 20.99 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.766 0.317 . . . . 0.0 111.039 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.94 -13.02 54.62 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.351 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.43 ' CE2' ' HG2' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -86.8 102.63 14.46 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.438 0.637 . . . . 0.0 109.889 179.604 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptt180 -139.72 143.44 37.03 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.266 -178.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.466 ' O ' ' CE1' ' A' ' 27' ' ' PHE . 1.5 ttm105 177.2 -165.36 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.931 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.41 64.92 8.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.892 0.377 . . . . 0.0 111.017 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.84 -38.08 3.23 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.234 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -62.19 -19.01 62.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.688 0.28 . . . . 0.0 111.119 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.422 ' HB3' ' CG ' ' A' ' 20' ' ' TYR . 5.5 m -165.67 148.86 7.8 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.597 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.466 ' CE1' ' O ' ' A' ' 22' ' ' ARG . 2.1 m-30 -154.64 161.65 41.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.947 0.403 . . . . 0.0 111.176 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -60.18 -179.7 0.12 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.555 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 15.1 mt -84.09 103.5 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.18 0.514 . . . . 0.0 110.987 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 170.21 -144.1 8.24 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.34 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -147.92 128.36 14.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.858 0.361 . . . . 0.0 110.998 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.4 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.4 p-10 -124.75 133.12 53.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.21 145.61 26.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.069 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.606 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -113.33 143.07 45.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.191 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.606 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.62 156.72 39.09 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-O 121.091 0.472 . . . . 0.0 110.402 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -70.24 115.64 9.67 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.415 0.626 . . . . 0.0 111.551 -177.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.9 OUTLIER -129.72 -173.24 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.958 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.41 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 1.7 t -65.35 -59.19 4.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.552 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -171.2 -16.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.1 m -42.23 -40.82 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HB3' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.37 -43.04 83.2 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.216 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.503 ' N ' HE21 ' A' ' 41' ' ' GLN . 19.7 tp -64.52 -55.36 21.11 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.194 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.99 -23.14 62.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.537 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.25 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.861 0.362 . . . . 0.0 110.276 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.414 ' CD1' HG21 ' A' ' 12' ' ' VAL . 0.8 OUTLIER -78.93 -57.47 3.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.931 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.404 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -51.85 -23.27 4.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.609 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -43.37 -31.43 0.67 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.781 0.324 . . . . 0.0 111.498 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.04 128.01 24.59 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.683 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.95 77.42 2.73 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.426 2.084 . . . . 0.0 112.22 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.43 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -146.54 -45.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.184 -179.846 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -110.61 124.8 52.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.974 0.416 . . . . 0.0 110.827 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.401 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.0 t -64.7 106.06 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.625 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.404 HG11 ' HB2' ' A' ' 46' ' ' LYS . 2.9 p -99.03 123.97 51.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.147 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.406 ' O ' ' CG2' ' A' ' 10' ' ' VAL . 19.8 pt20 -127.0 141.09 51.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.081 -178.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.529 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -100.58 112.7 34.15 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.039 179.539 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.3 t -122.42 104.67 9.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.02 62.06 1.54 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.839 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.4 p -162.66 174.76 12.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.876 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 104.34 165.2 24.64 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.523 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.6 m -135.45 80.04 1.81 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.347 . . . . 0.0 110.926 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -153.09 141.55 20.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.881 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -102.87 117.23 34.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.927 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.61 175.91 19.13 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.536 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -144.19 -58.42 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.526 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 60.6 30.97 20.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.53 68.44 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.57 24.73 12.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.674 0.274 . . . . 0.0 110.909 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.7 m -165.18 175.94 8.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.954 0.407 . . . . 0.0 110.796 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -115.11 -38.9 3.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.793 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -164.35 141.54 5.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.38 -61.9 0.4 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.482 2.121 . . . . 0.0 112.271 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.01 -47.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.065 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.91 -86.94 0.34 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.475 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.0 p 49.67 88.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.82 0.343 . . . . 0.0 111.216 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 63.63 135.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -118.29 -36.3 3.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.068 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -119.19 179.97 4.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.924 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.84 55.29 0.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.815 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 63.06 142.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.948 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.0 mt -147.61 78.73 1.47 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.869 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.86 148.92 50.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.768 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -177.12 -37.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.271 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.2 t0 69.77 78.94 0.22 Allowed Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.882 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.47 ' N ' ' HD2' ' A' ' 85' ' ' PRO . 2.3 Cg_endo -42.8 -57.65 1.62 Allowed 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.919 2.413 . . . . 0.0 112.828 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 84' ' ' PRO . 19.5 Cg_endo -59.43 -70.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.27 1.98 . . . . 0.0 112.245 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.6 t 63.47 131.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.985 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.4 m 59.48 160.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.953 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 4.9 m-20 58.58 165.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 2.3 mm? 70.1 -46.26 0.6 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.824 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -48.44 -45.02 35.91 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.565 0.221 . . . . 0.0 111.288 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 p -62.11 -13.21 24.48 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -90.07 115.61 27.47 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.681 0.277 . . . . 0.0 110.427 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 90.4 m -91.22 -107.46 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.778 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.697 ' O ' HD21 ' A' ' 97' ' ' LEU . 10.0 m -135.61 -32.02 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.25 0 CA-C-O 120.916 0.389 . . . . 0.0 111.494 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -83.58 -20.0 34.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.736 0.303 . . . . 0.0 111.068 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -81.53 -32.61 32.21 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' O ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -77.87 -50.03 13.07 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -179.788 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.42 ' CE ' ' O ' ' A' ' 94' ' ' VAL . 3.3 ptpt -62.24 -28.11 69.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.86 -30.39 24.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.963 0.411 . . . . 0.0 111.98 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -86.82 -27.9 23.24 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.597 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 6.5 mt -64.73 -47.23 79.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.261 0.553 . . . . 0.0 109.742 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -34.83 74.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.749 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.28 -12.57 61.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.314 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 101' ' ' LEU . 9.6 ptm180 -110.89 -15.26 13.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.052 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.05 82.72 0.79 Allowed Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.791 -0.718 . . . . 0.0 113.16 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.439 HG22 ' CD2' ' A' ' 101' ' ' LEU . 8.4 tp -126.74 -40.83 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.698 0.285 . . . . 0.0 111.376 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.416 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.2 OUTLIER 73.65 90.83 0.09 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.846 0.355 . . . . 0.0 110.624 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.1 p90 -115.26 139.03 50.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.114 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -43.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.788 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -128.22 27.41 5.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.67 30.27 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.97 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.488 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -178.46 59.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.015 0.436 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.79 -83.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.496 ' HA ' HD21 ' A' ' 117' ' ' LEU . 4.3 ptpt -139.62 -43.79 0.44 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.812 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.86 -24.5 41.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.998 0.428 . . . . 0.0 110.253 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -86.19 -36.55 19.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.837 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.515 HD22 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.97 -21.57 50.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.375 -179.145 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.515 ' N ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.12 -27.54 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.148 177.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.21 -34.17 19.09 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.143 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.7 OUTLIER -49.33 -46.26 46.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.871 -179.003 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.597 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 53.0 m-85 -54.68 86.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.399 . . . . 0.0 111.348 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.44 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -127.88 152.64 77.55 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.946 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.94 92.41 0.21 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.595 2.196 . . . . 0.0 112.278 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -130.08 138.11 50.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.093 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 8.8 t70 60.15 160.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 151.16 44.68 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.491 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -80.75 169.87 17.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.829 0.347 . . . . 0.0 110.918 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 7.5 tptt -155.62 -51.27 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.857 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.1 121.37 14.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -149.91 97.46 2.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.882 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.048 179.995 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.14 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m -110.33 106.35 15.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.825 0.345 . . . . 0.0 110.834 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -108.45 159.22 16.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.009 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 20.5 ptm 42.56 87.61 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.535 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.14 110.21 7.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.904 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.45 99.58 2.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.989 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.4 HG22 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER -84.86 135.95 33.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.598 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.472 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.15 146.46 31.79 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.523 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.3 p -96.9 119.81 36.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.588 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.76 151.55 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.176 0.513 . . . . 0.0 111.633 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.547 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -134.94 126.27 46.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.086 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 9.0 m -95.86 104.77 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.341 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -88.82 106.56 18.46 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.406 ' HB2' ' CD1' ' A' ' 16' ' ' ILE . 1.0 OUTLIER -98.22 144.11 28.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.447 0.641 . . . . 0.0 111.946 -179.294 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.426 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . 0.4 OUTLIER -139.12 35.29 2.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.607 178.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.406 ' CD1' ' HB2' ' A' ' 14' ' ' ASN . 2.8 mp -77.02 -61.81 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.578 -178.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt 177.39 32.32 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.419 ' HA ' ' N ' ' A' ' 29' ' ' LEU . 0.1 OUTLIER 51.89 26.0 3.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.715 0.293 . . . . 0.0 111.274 179.608 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -179.07 77.52 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.354 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.42 ' CE2' ' HG2' ' A' ' 50' ' ' ARG . 41.7 t80 -150.17 32.73 0.66 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.923 0.392 . . . . 0.0 110.934 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.5 mmt-85 60.56 170.69 0.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.609 179.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? 179.92 -70.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.819 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.58 13.19 30.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.141 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.44 29.32 3.98 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.85 -0.691 . . . . 0.0 111.395 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.25 162.04 8.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.672 -0.264 . . . . 0.0 110.398 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.12 80.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.768 0.318 . . . . 0.0 110.682 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.42 ' CZ ' ' HB2' ' A' ' 32' ' ' ASN . 5.8 t80 -60.78 128.47 36.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.896 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -69.45 155.2 40.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.64 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.426 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -64.03 94.57 0.1 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.157 0.503 . . . . 0.0 110.511 179.902 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -167.36 -133.45 1.54 Allowed Glycine 0 N--CA 1.45 -0.433 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.871 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.457 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 36.4 p-10 -157.09 142.14 17.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.908 0.385 . . . . 0.0 111.483 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.547 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.8 t-20 -122.01 136.46 54.92 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.083 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.02 145.2 26.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.492 0.663 . . . . 0.0 111.715 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.7 OUTLIER -111.97 141.44 45.63 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.885 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.579 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.39 157.58 37.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.393 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.435 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.5 112.02 5.73 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.622 0.725 . . . . 0.0 111.243 -177.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.4 ' CA ' HG22 ' A' ' 7' ' ' THR . 5.3 t -127.84 168.62 20.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.64 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.4 t -54.36 -62.07 1.9 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.525 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -164.92 -16.61 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.42 -45.27 4.31 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.502 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -53.4 -47.04 69.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.801 0.334 . . . . 0.0 111.693 -179.619 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.437 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 8.7 tp -57.89 -46.56 84.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.518 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.18 -28.44 48.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.661 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -50.69 67.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.938 0.399 . . . . 0.0 110.712 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.454 HD11 ' CG1' ' A' ' 10' ' ' VAL . 32.4 mt -79.0 -34.3 44.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.414 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -77.7 -10.27 59.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.322 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.47 -45.54 73.19 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.717 0.294 . . . . 0.0 111.261 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -93.28 127.95 44.7 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -79.31 85.79 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.518 2.145 . . . . 0.0 112.565 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.42 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -167.13 -72.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.855 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.47 171.03 3.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.609 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.5 t -115.35 106.75 21.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.927 0.394 . . . . 0.0 111.908 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.409 HG23 ' HB2' ' A' ' 45' ' ' LEU . 1.3 p -104.02 111.19 32.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.05 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.505 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.3 mm-40 -127.17 133.54 50.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.523 -179.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.514 ' HA ' HG22 ' A' ' 10' ' ' VAL . 2.6 pp -88.31 133.37 30.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.119 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.3 p -122.27 104.57 9.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.792 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -61.89 1.35 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.909 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.3 t -153.1 -46.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.885 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.3 -161.51 30.17 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.534 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.29 -36.65 20.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.878 0.37 . . . . 0.0 110.984 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -174.62 -60.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -175.21 -56.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.953 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 94.92 146.43 20.72 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.54 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.18 47.47 0.27 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.473 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -126.78 41.81 3.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.923 0.392 . . . . 0.0 110.856 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 133.64 -28.43 3.25 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.51 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.2 tt -95.5 113.1 24.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 110.908 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.73 -76.8 0.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.856 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm -149.65 -47.98 0.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.954 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -117.84 113.25 38.04 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.866 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -77.12 -0.99 11.14 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.494 2.129 . . . . 0.0 112.807 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -52.96 -76.17 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.806 0.336 . . . . 0.0 111.289 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 142.34 -53.94 0.62 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.497 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.81 32.56 18.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.787 0.327 . . . . 0.0 110.914 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.72 -48.56 3.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.868 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.37 158.57 25.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.907 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -143.25 -48.82 0.32 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.17 174.36 10.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.5 105.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.875 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.09 142.03 47.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 -61.35 -176.15 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -94.07 170.75 9.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.096 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.55 145.84 50.54 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -51.81 104.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.632 2.221 . . . . 0.0 112.292 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -65.98 69.36 0.4 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.674 2.249 . . . . 0.0 112.161 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.8 p -159.11 109.02 1.95 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.928 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 39.0 m -144.77 -47.12 0.24 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.903 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -141.0 -46.94 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.877 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.427 ' HA ' ' CD1' ' A' ' 92' ' ' PHE . 8.7 tp -62.38 -18.7 62.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.294 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -49.17 -50.25 38.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.655 0.265 . . . . 0.0 111.125 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.22 -10.18 14.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.427 ' CD1' ' HA ' ' A' ' 89' ' ' LEU . 4.4 m-85 -88.29 120.92 30.11 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.6 0.238 . . . . 0.0 110.528 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.8 -91.48 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.536 ' HA ' HD21 ' A' ' 97' ' ' LEU . 20.4 t -131.39 -44.58 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 121.027 0.441 . . . . 0.0 111.65 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -82.29 -19.99 38.39 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -85.72 -29.29 24.04 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.567 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.59 -55.24 4.23 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.453 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.545 ' HE2' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -55.13 -32.83 62.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.794 178.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.36 -24.85 27.42 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.989 0.423 . . . . 0.0 112.086 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 121' ' ' PHE . 71.5 mt-30 -86.57 -45.29 11.2 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.923 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.435 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 4.7 mt -50.89 -49.05 60.16 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.994 0.426 . . . . 0.0 110.38 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -38.27 86.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.113 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -77.17 -6.69 53.92 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.333 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -104.07 -15.18 15.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.215 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.98 47.02 4.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.549 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.7 mm -133.38 91.21 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 0.0 111.078 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 27.3 p -54.64 119.82 5.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.953 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 108' ' ' PHE . 14.6 p90 -117.5 74.24 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.873 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.29 39.81 2.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.759 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -121.49 -47.03 2.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.013 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.16 33.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.039 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -116.66 90.1 3.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.987 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.84 -76.67 0.15 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.04 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.512 ' HA ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -147.21 -39.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -77.57 -22.12 51.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 110.658 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 12.7 mm-40 -85.58 -37.96 18.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.85 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.557 HD21 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -82.37 -19.89 38.28 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.302 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.557 ' N ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.64 -25.24 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.589 177.749 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.72 -35.38 19.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.392 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -33.51 74.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.435 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 0.8 OUTLIER -60.29 84.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.258 -179.702 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.53 126.7 90.74 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.844 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.91 151.35 84.34 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.424 2.083 . . . . 0.0 112.353 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -99.84 136.92 39.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.094 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -176.77 -40.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.847 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -109.75 -110.94 3.35 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.483 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 43.73 60.43 2.67 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 111.399 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -96.93 88.1 4.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.97 102.24 3.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.808 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -122.78 117.81 26.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.962 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.215 179.965 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.0 p -86.05 161.63 18.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.772 0.32 . . . . 0.0 111.016 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -144.3 158.26 43.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.901 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 ttm -100.66 171.77 7.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.837 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 61.89 73.88 0.46 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.148 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.07 65.85 0.92 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.387 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.486 HG23 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER -165.68 147.5 7.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.467 -179.36 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.461 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.9 135.29 24.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.675 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -89.74 119.98 30.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.617 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.88 156.0 10.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.905 0.383 . . . . 0.0 111.759 -177.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.22 117.48 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.069 0.461 . . . . 0.0 110.718 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 27.1 m -93.14 110.37 23.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.166 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -91.86 111.54 23.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.49 144.48 26.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.301 0.572 . . . . 0.0 111.595 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.415 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -143.06 33.99 1.36 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.792 179.139 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mp -99.27 -58.3 3.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.589 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -151.86 -178.54 6.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.632 0.253 . . . . 0.0 110.862 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.83 37.78 1.87 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.897 0.379 . . . . 0.0 110.776 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.12 74.88 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.28 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.571 ' O ' ' HD2' ' A' ' 21' ' ' ARG . 3.1 t80 -132.08 98.82 4.53 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.806 0.336 . . . . 0.0 110.365 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.571 ' HD2' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 47.41 175.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.697 179.611 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.467 ' HB2' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER 71.52 178.28 0.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.139 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.425 ' HB2' ' CE1' ' A' ' 25' ' ' PHE . . . 59.93 11.82 2.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.448 -178.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' A' ' 25' ' ' PHE . . . 83.98 14.01 73.33 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.974 -0.632 . . . . 0.0 112.223 -179.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.435 ' HB3' ' O ' ' A' ' 24' ' ' GLY . 0.2 OUTLIER 178.21 -46.51 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER 174.54 118.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.252 -179.449 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -85.36 156.41 20.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.344 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -85.07 175.77 8.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.098 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' CD2' ' HA ' ' A' ' 15' ' ' ARG . 8.4 mt -65.75 93.45 0.18 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.046 0.451 . . . . 0.0 110.638 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -168.41 -139.41 2.69 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.55 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.443 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 22.8 p-10 -152.41 146.95 25.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.841 0.353 . . . . 0.0 111.007 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.414 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 0.9 OUTLIER -125.0 135.48 52.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.411 179.795 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.5 m -87.11 145.5 26.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.343 0.592 . . . . 0.0 111.069 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.617 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -114.26 140.2 48.78 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.981 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.576 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.17 157.55 37.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.005 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.471 ' CB ' ' HB ' ' A' ' 7' ' ' THR . . . -69.38 106.43 2.93 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.769 0.795 . . . . 0.0 111.168 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.486 ' CA ' HG23 ' A' ' 7' ' ' THR . 5.0 t -124.53 167.61 18.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 114.36 -1.291 . . . . 0.0 110.705 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.51 -64.95 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.433 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -160.25 -16.37 0.05 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.6 m -42.19 -38.14 1.65 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.554 ' CB ' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -63.22 -53.38 54.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.911 0.386 . . . . 0.0 111.309 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.423 ' N ' ' NE2' ' A' ' 41' ' ' GLN . 5.0 tp -57.78 -28.31 63.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.511 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -90.41 -40.47 12.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.683 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.6 tm0? -62.21 -40.73 97.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.808 0.337 . . . . 0.0 110.756 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.465 ' CD1' HG13 ' A' ' 10' ' ' VAL . 7.3 mt -78.84 -39.83 34.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.257 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -65.98 -12.89 58.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.537 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.46 -28.84 2.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.681 0.277 . . . . 0.0 111.504 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -129.48 110.02 17.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.13 -22.66 11.32 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.655 2.237 . . . . 0.0 112.654 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -45.79 -63.7 0.91 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.879 0.371 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.02 170.4 16.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.8 t -119.44 108.28 23.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.884 0.373 . . . . 0.0 111.679 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.408 ' CB ' ' HB2' ' A' ' 45' ' ' LEU . 1.5 p -105.89 111.32 34.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.494 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.496 ' O ' HG21 ' A' ' 10' ' ' VAL . 16.0 mt-30 -127.52 130.9 49.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.583 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.501 ' HA ' HG21 ' A' ' 10' ' ' VAL . 2.6 pp -88.13 145.35 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.064 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.1 p -122.26 104.55 9.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.684 179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.39 84.65 1.47 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.708 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.9 p -47.74 95.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.207 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 154.87 -64.41 0.33 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.86 -0.685 . . . . 0.0 112.407 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.5 t 62.66 -80.03 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.756 0.312 . . . . 0.0 111.132 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -118.81 168.88 10.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.866 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -79.43 81.16 5.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.896 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.46 141.54 11.03 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.479 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 143.15 -149.81 21.72 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.475 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 61.14 114.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.91 0.386 . . . . 0.0 110.873 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 178.28 -36.14 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.483 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.55 -30.95 70.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.767 0.318 . . . . 0.0 110.788 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.5 m 60.67 177.23 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.767 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -72.43 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.851 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.442 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 1.6 mt-10 172.34 -53.84 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.215 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 28.0 Cg_exo -62.08 168.77 8.59 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.472 2.114 . . . . 0.0 112.289 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.48 -38.65 3.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.137 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -87.41 162.08 33.07 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.539 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 m -96.4 85.29 3.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.859 0.362 . . . . 0.0 110.915 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -114.46 -37.1 4.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.889 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 61.74 -169.11 0.18 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.855 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 61.33 170.64 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 173.36 12.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.871 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.63 62.07 5.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.962 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.8 tp -169.24 98.03 0.35 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.852 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -164.27 136.67 4.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.976 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -171.06 -59.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.968 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -128.56 138.11 32.38 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.759 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.31 111.27 3.23 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.533 2.155 . . . . 0.0 112.462 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -77.58 -25.01 8.44 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.489 2.126 . . . . 0.0 112.302 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.86 -47.22 77.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.173 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.1 m -88.41 72.03 8.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.951 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -138.3 -56.86 0.65 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.702 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.0 tp -70.89 -17.76 62.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.11 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -49.05 -47.2 45.01 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.437 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.5 p -62.33 -9.31 7.74 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.407 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 4.7 m-85 -100.16 137.27 38.83 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.602 0.239 . . . . 0.0 110.504 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -123.17 -96.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.708 -0.223 . . . . 0.0 111.555 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.619 ' HA ' HD23 ' A' ' 97' ' ' LEU . 4.2 m -142.97 -34.03 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -83.27 -20.47 34.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.257 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.414 ' O ' ' CB ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -83.34 -38.19 22.39 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.619 HD23 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -73.3 -46.28 50.51 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.355 -179.392 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.409 ' HE3' ' HB2' ' A' ' 98' ' ' LYS . 3.1 ttmt -60.86 -37.29 81.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.885 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.28 -24.22 27.82 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 61.6 tt0 -86.82 -43.7 12.29 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.202 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 117' ' ' LEU . 2.8 mt -55.7 -47.48 76.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.151 0.501 . . . . 0.0 110.121 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -42.06 98.25 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.246 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -8.15 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.041 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.72 -15.32 18.54 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.9 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.75 51.36 2.88 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.972 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.452 ' CG2' HD23 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -133.43 88.6 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.925 0.393 . . . . 0.0 111.022 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 156.27 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.091 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.477 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -142.76 -105.74 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.829 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.11 33.05 1.01 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.735 0.302 . . . . 0.0 111.556 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.86 -35.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.238 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 11.2 t -111.82 -32.17 6.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.08 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -114.09 119.81 38.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.903 0.382 . . . . 0.0 111.262 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -112.9 -55.58 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.606 ' HA ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -166.25 -39.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.629 179.549 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.11 -22.27 33.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.939 0.399 . . . . 0.0 110.632 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -85.96 -38.11 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.54 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -80.65 -21.18 41.64 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.342 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.561 ' N ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -84.52 -28.36 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.933 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.03 -34.1 19.32 Favored 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.385 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.0 mp -55.4 -34.1 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.402 -179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.534 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 8.8 m-85 -70.69 -29.35 65.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.73 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.465 ' CB ' ' HD3' ' A' ' 123' ' ' PRO . . . -51.26 -61.24 4.31 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.821 -0.172 . . . . 0.0 111.255 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.465 ' HD3' ' CB ' ' A' ' 122' ' ' ALA . 71.9 Cg_exo -47.92 175.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.46 2.107 . . . . 0.0 112.371 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -129.69 -62.38 0.97 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.126 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -56.79 148.93 19.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.037 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -157.05 59.35 0.35 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.483 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.67 115.75 30.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.77 0.319 . . . . 0.0 110.987 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -139.2 37.76 2.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.954 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.24 101.62 8.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.894 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -74.81 -65.21 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.947 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.276 -0.869 . . . . 0.0 111.13 -179.978 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -31.89 73.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -152.06 59.1 0.85 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.745 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.2 ttp -83.05 111.24 18.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.128 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.61 141.59 45.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.87 22.39 1.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.639 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.569 ' HA ' ' O ' ' A' ' 37' ' ' VAL . 13.6 t -126.58 129.6 48.87 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.048 0.451 . . . . 0.0 110.732 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.532 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.58 146.79 29.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.323 -179.575 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -89.04 124.65 34.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.632 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -110.37 153.6 12.1 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-O 121.322 0.582 . . . . 0.0 112.255 -178.06 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.2 p -138.68 123.73 22.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.197 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 35.6 m -93.37 108.87 21.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.966 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -90.0 106.52 18.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.97 146.47 24.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.104 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -138.01 30.43 2.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.51 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.1 mp -95.95 -53.92 7.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.306 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.6 pttt -175.4 -175.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.203 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -111.75 46.92 1.08 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.923 0.392 . . . . 0.0 110.631 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.61 29.99 0.18 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.745 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -95.85 -35.99 11.28 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 120.874 0.369 . . . . 0.0 110.075 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.542 ' HA ' ' HA ' ' A' ' 27' ' ' PHE . 0.2 OUTLIER 57.75 -176.72 0.07 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.274 0.559 . . . . 0.0 112.264 177.595 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.81 -165.59 0.32 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.793 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.43 72.23 9.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.914 0.387 . . . . 0.0 111.202 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.84 13.16 60.99 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.8 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.413 ' CD1' HD22 ' A' ' 45' ' ' LEU . 69.1 m-85 -107.48 -55.32 2.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.994 0.426 . . . . 0.0 110.744 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 t -114.83 148.83 37.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.825 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.542 ' HA ' ' HA ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -163.74 30.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.667 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 173.99 -171.64 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.394 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.435 HD22 ' O ' ' A' ' 17' ' ' LYS . 3.4 tm? -96.6 105.69 17.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.994 0.426 . . . . 0.0 110.407 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 160.44 -138.66 5.64 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.147 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 2.7 p30 -143.3 143.68 31.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 m-80 -122.41 145.75 47.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.052 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.31 145.31 26.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.469 0.652 . . . . 0.0 111.906 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.632 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -114.28 139.41 49.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.641 179.526 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.622 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -71.28 155.26 40.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.089 0.471 . . . . 0.0 110.612 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -71.23 114.37 9.23 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.327 0.584 . . . . 0.0 112.013 -178.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 7' ' ' THR . 0.8 OUTLIER -126.09 -171.66 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.232 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.422 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 2.0 m -89.97 57.59 3.87 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 78.51 -16.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -21.51 4.39 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.523 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -79.96 -28.3 39.61 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.088 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 tp -83.51 -31.78 26.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.018 0.437 . . . . 0.0 110.901 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.66 -29.07 22.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.02 -40.35 82.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.121 0.486 . . . . 0.0 109.986 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.453 ' CB ' ' HB ' ' A' ' 53' ' ' VAL . 49.0 mt -78.82 -39.58 35.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.782 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -28.04 67.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.031 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.32 -29.88 25.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.337 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.82 118.15 47.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.784 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -85.35 42.67 1.11 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.764 2.309 . . . . 0.0 112.765 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mtp85 -119.79 -38.78 2.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.741 0.305 . . . . 0.0 110.625 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.46 -179.11 3.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.179 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 4.7 m -117.99 137.4 52.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.695 0.283 . . . . 0.0 111.626 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.453 ' HB ' ' CB ' ' A' ' 45' ' ' LEU . 4.0 p -125.96 113.1 32.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.094 0.474 . . . . 0.0 110.962 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.443 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.8 mt-30 -127.66 135.57 50.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.325 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.54 ' HA ' HG22 ' A' ' 10' ' ' VAL . 1.5 pp -88.56 113.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.491 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.47 104.58 9.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.674 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -120.62 94.25 4.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.836 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.03 33.73 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 170.95 157.71 13.47 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.549 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.6 m -110.01 133.81 52.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.869 0.366 . . . . 0.0 110.963 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -152.07 152.9 32.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.874 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.76 -62.27 0.97 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.9 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 113.33 59.16 0.41 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.55 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 172.97 90.96 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.659 -0.782 . . . . 0.0 112.464 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 60.36 33.65 20.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.826 0.346 . . . . 0.0 110.99 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.95 -139.47 10.44 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.518 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.54 98.05 4.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.77 0.319 . . . . 0.0 110.879 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.9 m -125.65 107.81 10.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.026 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -162.61 58.32 0.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.785 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.425 ' N ' ' HD2' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -179.63 -61.56 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.004 -179.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 70' ' ' GLU . 30.7 Cg_endo -63.62 -175.31 0.26 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.478 2.119 . . . . 0.0 112.351 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 62.3 75.76 0.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.014 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 146.53 -46.39 0.75 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.492 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.71 -177.68 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.876 0.37 . . . . 0.0 110.896 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -92.83 164.32 13.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.921 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.2 138.63 50.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -153.75 173.68 15.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.893 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.3 pttt -64.72 -179.1 0.47 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.906 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 -59.96 121.55 12.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.83 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -171.03 144.45 2.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.838 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 18.5 mmm-85 61.8 43.34 9.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.93 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.19 167.06 19.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.042 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.421 ' N ' ' CD ' ' A' ' 84' ' ' PRO . 0.8 OUTLIER -86.78 -52.22 0.43 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.904 -179.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 83' ' ' ASP . 25.9 Cg_exo -62.36 109.71 0.91 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.54 2.16 . . . . 0.0 112.295 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.34 141.67 23.14 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.521 2.147 . . . . 0.0 112.365 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t 58.56 49.93 9.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.919 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.5 p 58.65 160.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.989 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.435 ' O ' ' CE1' ' A' ' 92' ' ' PHE . 0.3 OUTLIER 179.89 -38.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 tp -107.69 -48.28 3.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.092 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -48.95 -42.77 38.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.464 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 35.3 m -61.89 -15.7 44.8 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.435 ' CE1' ' O ' ' A' ' 88' ' ' ASP . 32.4 m-85 -94.16 91.12 6.63 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 120.889 0.376 . . . . 0.0 110.227 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.3 p -65.09 -105.41 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.748 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.74 ' HA ' HD21 ' A' ' 97' ' ' LEU . 16.1 t -132.56 -56.48 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.876 0.369 . . . . 0.0 111.601 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.42 -19.78 66.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.113 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.17 -21.44 36.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.214 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.74 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -74.39 -58.68 3.14 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.413 ' HB2' ' CZ ' ' A' ' 108' ' ' PHE . 2.3 ptpt -59.75 -29.83 68.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.667 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.53 -25.71 28.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.077 0.465 . . . . 0.0 111.75 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -86.73 -36.25 18.75 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.668 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.486 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 7.8 mt -58.54 -48.13 81.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.221 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -38.49 84.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.965 179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.97 -6.7 55.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.185 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -102.79 -15.27 16.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.266 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.4 36.99 4.17 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.634 -0.794 . . . . 0.0 112.863 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.9 mp -141.56 91.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.72 0.295 . . . . 0.0 111.201 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.8 t -59.96 159.59 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.971 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 1.8 p90 -150.14 72.82 1.13 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.691 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -66.02 -67.98 0.4 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.083 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -140.6 32.93 1.83 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -111.67 -34.3 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.877 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -119.84 85.5 2.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.891 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -85.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.114 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.52 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -140.44 -37.18 0.46 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.479 ' N ' ' HG2' ' A' ' 114' ' ' LYS . . . -83.18 -23.81 32.74 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -85.82 -36.88 19.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.357 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.566 HD21 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -80.09 -19.64 46.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.93 -179.655 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.566 ' N ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.59 -28.13 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.06 -33.56 19.48 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.998 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.474 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 5.6 tp -49.24 -41.03 36.2 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.085 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.486 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 20.9 m-85 -64.67 78.91 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.217 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.586 ' CB ' ' HD3' ' A' ' 123' ' ' PRO . . . -167.1 -62.24 0.01 OUTLIER Pre-proline 0 CA--C 1.531 0.226 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.586 ' HD3' ' CB ' ' A' ' 122' ' ' ALA . 2.8 Cg_exo -76.23 65.16 7.13 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.543 2.162 . . . . 0.0 112.261 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -146.27 153.02 40.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.129 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.6 168.8 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -172.33 -105.68 0.19 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.486 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -172.04 151.63 2.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.883 0.373 . . . . 0.0 110.961 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -105.68 151.11 24.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.846 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 1.4 m -121.47 88.35 2.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.952 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -137.43 131.72 32.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.918 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.094 -179.936 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 112.446 -0.262 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.5 m 61.19 154.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.892 0.377 . . . . 0.0 110.997 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -140.3 -69.62 0.4 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.884 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 5.7 ttt -178.63 -39.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.865 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -59.29 97.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.008 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.3 tttp -139.17 -171.41 3.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.441 HG21 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER -175.08 139.78 0.49 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.952 -179.847 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.489 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.05 143.26 30.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.404 0.621 . . . . 0.0 112.493 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.5 p -95.54 121.67 37.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.587 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.8 150.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.025 0.441 . . . . 0.0 111.228 -179.005 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.2 p -135.82 124.54 38.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.298 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 11.3 m -93.14 104.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.369 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.36 108.02 19.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.628 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.429 ' ND2' HD11 ' A' ' 51' ' ' LEU . 8.4 t30 -127.24 146.52 50.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.189 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -131.34 45.23 2.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.645 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.47 ' CG2' ' HG3' ' A' ' 17' ' ' LYS . 1.7 mp -93.65 -73.1 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.84 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.47 ' HG3' ' CG2' ' A' ' 16' ' ' ILE . 2.4 mtpm? -156.51 -173.96 4.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.781 0.324 . . . . 0.0 110.903 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -87.24 -31.22 20.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.92 0.39 . . . . 0.0 110.705 179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.11 46.83 1.11 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.299 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.429 ' CE2' HG12 ' A' ' 16' ' ' ILE . 2.1 t80 -91.44 11.37 24.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.735 0.302 . . . . 0.0 111.136 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 59.39 176.03 0.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.151 0.501 . . . . 0.0 111.613 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -177.75 -68.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.445 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.1 14.29 27.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.704 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 105.77 31.23 4.27 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.399 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -173.83 166.92 4.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.642 0.258 . . . . 0.0 110.594 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 p -59.14 101.93 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.831 0.348 . . . . 0.0 110.191 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.401 ' CE1' ' O ' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -83.73 9.28 12.15 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.896 -179.088 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.401 ' O ' ' CE1' ' A' ' 27' ' ' PHE . 45.3 m-70 63.2 168.23 0.14 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.935 0.398 . . . . 0.0 111.229 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -97.27 106.73 19.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.797 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 165.68 -150.83 18.91 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.443 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -119.39 133.49 55.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.828 0.347 . . . . 0.0 110.92 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.444 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 8.9 m120 -116.34 124.46 50.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.617 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.16 145.62 26.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.464 0.649 . . . . 0.0 111.464 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.7 OUTLIER -113.41 139.9 48.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.331 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.573 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.29 157.58 37.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.161 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.46 111.44 5.32 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.761 0.791 . . . . 0.0 111.214 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.441 ' CA ' HG21 ' A' ' 7' ' ' THR . 4.5 t -127.6 168.3 20.98 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.461 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -69.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.742 0.306 . . . . 0.0 111.367 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -156.71 -16.6 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 87.6 p -42.47 -44.52 4.09 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.543 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.72 -47.03 77.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.807 0.337 . . . . 0.0 111.721 -179.606 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.456 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 6.7 tp -49.24 -55.41 12.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.469 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.87 -27.9 61.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.18 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -51.77 68.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.662 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.453 ' CB ' ' HB ' ' A' ' 53' ' ' VAL . 2.9 mm? -78.82 -44.19 23.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.875 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -17.71 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.245 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.77 -67.72 0.25 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.85 0.357 . . . . 0.0 111.56 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.91 133.58 41.04 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -84.98 48.64 2.38 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.689 2.259 . . . . 0.0 112.566 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -111.42 -38.43 4.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.85 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.429 HD11 ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -112.96 -176.51 2.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.728 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 m -116.34 128.57 73.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.213 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.453 ' HB ' ' CB ' ' A' ' 45' ' ' LEU . 3.3 p -116.09 116.27 51.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.52 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.09 120.65 29.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.239 -179.759 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.489 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -88.36 139.26 17.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.24 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p -122.2 104.47 9.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.611 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -151.1 102.93 2.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.784 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.4 t -51.49 93.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.168 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -165.52 -178.11 38.34 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.486 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.5 m -161.4 165.14 29.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.828 0.347 . . . . 0.0 110.927 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -142.79 55.18 1.4 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.55 130.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.866 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -105.88 75.86 0.23 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.438 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.47 -125.27 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.447 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -104.3 -66.67 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.772 0.32 . . . . 0.0 110.936 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.28 -164.46 19.2 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.44 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.1 tp -116.97 -63.57 1.43 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.848 0.356 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 t 60.95 63.95 1.2 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.12 145.13 39.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.889 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -146.74 91.11 5.34 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.807 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -50.95 117.66 3.56 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.561 2.174 . . . . 0.0 112.403 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.61 128.27 56.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.115 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -131.69 -78.47 0.16 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.51 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.04 152.03 24.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.821 0.343 . . . . 0.0 110.884 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -105.7 -39.46 6.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.913 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.07 151.42 36.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.865 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.94 -39.93 2.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.111 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.12 -19.17 62.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.315 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 61.59 81.63 0.19 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.871 0.367 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -93.67 -35.8 12.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.867 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.18 159.27 44.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.927 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -98.77 146.22 26.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.031 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.63 136.13 95.98 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.912 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.67 149.85 34.57 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.5 2.133 . . . . 0.0 112.358 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -74.21 -168.26 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.481 2.121 . . . . 0.0 112.347 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.2 p 62.06 118.46 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.001 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -127.8 -176.21 3.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.844 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -159.0 -51.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.933 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -95.63 -24.99 16.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.105 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -49.02 -45.81 43.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.512 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -13.91 31.2 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -106.17 144.8 32.36 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 110.71 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.407 ' OG1' ' N ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -98.98 -104.67 0.21 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.974 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.407 ' N ' ' OG1' ' A' ' 93' ' ' THR . 2.9 m -144.86 -38.71 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.763 0.316 . . . . 0.0 111.17 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -82.11 -21.2 36.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.461 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.2 OUTLIER -70.28 -52.35 23.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.289 0.566 . . . . 0.0 109.754 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.558 HD13 HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -51.81 -57.91 7.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.53 179.185 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.597 ' HE2' HD13 ' A' ' 117' ' ' LEU . 1.8 ttmt -54.3 -36.78 64.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.544 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.89 -22.19 29.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.944 0.402 . . . . 0.0 112.001 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.451 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -87.0 -39.1 15.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.275 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.544 ' HG ' ' CE1' ' A' ' 121' ' ' PHE . 1.4 mt -59.68 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.165 0.507 . . . . 0.0 110.034 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -40.03 95.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.35 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.49 -6.56 53.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.289 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -100.18 -15.24 18.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.158 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.3 28.86 9.36 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.481 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.0 mt -121.95 88.43 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.762 0.315 . . . . 0.0 111.038 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 72.8 p -58.46 140.38 54.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.454 ' CE2' ' HG3' ' A' ' 98' ' ' LYS . 15.5 p90 -138.78 74.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.24 -71.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -122.27 28.04 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.07 -31.79 6.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.922 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -134.51 107.31 7.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -79.89 -80.15 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.072 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.628 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -141.74 -37.91 0.4 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.797 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.59 -21.16 38.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.877 0.37 . . . . 0.0 110.563 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -85.74 -38.85 17.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.705 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.686 HD21 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -79.89 -19.34 48.41 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.486 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.686 ' N ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.25 -27.73 7.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.823 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.78 -33.13 18.76 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.988 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.452 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 18.1 tp -49.05 -44.15 41.49 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.306 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.544 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 96.2 m-85 -68.26 70.77 0.17 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.296 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.607 ' CB ' ' HD3' ' A' ' 123' ' ' PRO . . . -162.48 -64.01 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.607 ' HD3' ' CB ' ' A' ' 122' ' ' ALA . 16.7 Cg_exo -67.66 101.89 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.258 1.972 . . . . 0.0 112.126 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.88 85.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.009 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -150.16 -178.0 6.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.879 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -155.87 -141.24 3.16 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.547 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -116.05 -42.46 3.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.841 0.353 . . . . 0.0 110.884 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.61 -45.21 0.98 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.93 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.08 142.16 31.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.955 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -141.04 162.72 34.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.889 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.106 180.0 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.9 t 63.5 125.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.777 0.322 . . . . 0.0 110.977 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 -95.4 -67.51 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -178.27 -68.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.849 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -165.87 150.46 8.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.881 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.84 31.58 4.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.437 ' OG1' ' CB ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -166.73 130.79 2.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.884 -179.986 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.44 ' H ' ' N ' ' A' ' 37' ' ' VAL . 0.2 OUTLIER -146.4 121.81 10.32 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.417 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.2 p -111.35 127.73 55.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 177.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.724 ' H ' ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.84 153.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.08 0.467 . . . . 0.0 111.613 -178.553 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.7 p -138.03 106.54 3.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 82.2 t -92.48 134.12 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.937 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -119.71 108.47 14.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.134 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.35 145.8 26.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.393 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.1 ttp-105 -131.48 34.98 3.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.913 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -104.58 -54.39 6.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.085 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -178.08 -174.12 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.846 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -97.84 27.5 4.42 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.864 0.364 . . . . 0.0 110.887 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.16 53.27 0.28 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.115 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -98.25 33.39 2.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.959 0.409 . . . . 0.0 111.052 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? 62.91 -169.62 0.19 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.609 178.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 66.63 -173.96 0.19 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.633 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.436 ' HB1' ' CE1' ' A' ' 25' ' ' PHE . . . 75.41 2.42 3.83 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.739 -178.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.39 15.27 69.25 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.396 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.446 ' N ' ' CD1' ' A' ' 25' ' ' PHE . 0.1 OUTLIER -179.69 -49.17 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.667 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 p 168.9 93.71 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.802 0.334 . . . . 0.0 110.658 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.418 ' CD2' ' HB2' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -61.21 139.25 58.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.971 -179.861 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -86.62 -172.0 3.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.956 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -99.49 107.65 19.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.659 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 156.29 -142.21 8.6 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.381 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.04 130.66 46.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.424 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.1 t-20 -122.87 128.02 49.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.589 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 61.4 m -87.26 145.44 26.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.131 0.491 . . . . 0.0 111.506 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.735 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 2.7 tm? -102.9 153.73 19.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.674 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.735 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -71.18 157.85 37.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 121.601 0.715 . . . . 0.0 112.805 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.437 ' CB ' ' OG1' ' A' ' 7' ' ' THR . . . -70.69 104.85 2.97 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.551 0.691 . . . . 0.0 110.843 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.44 ' N ' ' H ' ' A' ' 8' ' ' PHE . 1.1 t -115.43 -159.45 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.947 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.45 ' O ' ' CB ' ' A' ' 39' ' ' GLU . 4.9 m -107.74 40.82 1.64 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.725 0.297 . . . . 0.0 111.069 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.45 ' CB ' ' O ' ' A' ' 38' ' ' SER . 3.3 tt0 85.75 -18.58 0.35 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.226 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.0 m -50.44 -34.02 23.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.121 0.486 . . . . 0.0 110.323 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.596 ' CB ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.32 -44.81 76.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.383 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.455 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -57.24 -55.48 34.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.871 -179.415 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.53 -27.13 63.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -56.87 -51.04 70.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.465 ' HB3' ' HB ' ' A' ' 53' ' ' VAL . 0.5 OUTLIER -78.71 -52.96 7.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.665 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.88 -24.25 15.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.232 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.54 -29.71 1.91 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.437 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -117.85 117.79 35.31 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.763 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.05 68.44 5.8 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.455 2.104 . . . . 0.0 112.27 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mmt-85 -128.26 -43.82 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.101 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 56.6 mt -124.72 142.58 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.982 0.42 . . . . 0.0 111.143 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.29 111.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.348 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 1.4 p -98.56 118.19 44.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.127 0.489 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.9 144.79 48.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.397 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.534 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.8 pp -107.41 144.76 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.231 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 m -122.22 104.58 9.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.602 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -97.91 89.92 4.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.878 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.6 p -56.58 99.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.047 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 173.01 -41.55 0.16 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.475 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.3 m -147.75 95.6 2.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.786 0.326 . . . . 0.0 110.911 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.85 132.12 47.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -146.88 143.48 28.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.939 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -84.74 -151.8 14.86 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.562 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -175.22 -116.49 0.45 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.475 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -162.86 -176.16 4.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.816 0.341 . . . . 0.0 110.979 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -81.17 -147.55 5.6 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.469 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.69 179.92 3.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.832 0.348 . . . . 0.0 110.915 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 3.6 p -163.83 108.92 1.04 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.9 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.5 ptmt -125.79 79.65 1.84 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.99 146.74 33.12 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.892 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.62 150.8 51.58 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.543 2.162 . . . . 0.0 112.295 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -91.13 130.74 36.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.102 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 111.21 163.64 18.03 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.527 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.1 p -116.54 117.67 30.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.912 0.387 . . . . 0.0 110.922 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -122.52 135.75 54.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.931 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -105.64 -31.61 8.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.929 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -68.22 -38.62 82.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.884 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.48 -178.41 4.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -116.13 177.32 4.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.953 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -141.4 74.02 1.44 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.82 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -109.74 -25.4 10.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.04 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 65.27 84.92 0.15 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.062 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -146.1 113.51 4.52 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.762 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.483 ' N ' ' CD ' ' A' ' 85' ' ' PRO . 48.0 Cg_exo -54.76 -45.19 42.83 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.458 2.106 . . . . 0.0 112.499 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 84' ' ' PRO . 36.2 Cg_exo -57.52 85.81 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.368 2.045 . . . . 0.0 112.129 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.43 112.16 19.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.004 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 30.0 m -82.94 -45.32 14.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.837 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 t70 70.53 -63.3 0.41 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.052 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.46 ' HA ' ' CD1' ' A' ' 92' ' ' PHE . 47.6 tp -58.04 -19.53 32.18 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.52 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -49.04 -50.23 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.663 0.268 . . . . 0.0 111.408 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -1.3 9.82 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.46 ' CD1' ' HA ' ' A' ' 89' ' ' LEU . 2.4 m-85 -95.06 104.68 16.56 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.79 -92.41 0.53 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.531 ' CA ' HD21 ' A' ' 97' ' ' LEU . 2.0 t -125.5 -50.79 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-O 120.884 0.373 . . . . 0.0 111.773 -179.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.34 -19.39 39.41 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.07 -25.97 29.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.56 ' HG ' ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -81.77 -53.26 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.509 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' A' ' 94' ' ' VAL . 4.7 ptpt -57.92 -29.74 65.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.116 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.71 -25.47 28.34 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.41 ' CB ' ' CZ ' ' A' ' 121' ' ' PHE . 16.2 mt-30 -86.87 -32.83 20.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.459 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.471 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 9.4 mt -61.14 -48.87 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -38.08 86.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.968 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -75.46 -6.89 52.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.957 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -113.72 13.74 18.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.007 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 58.48 60.79 8.28 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.748 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.452 HG21 HD13 ' A' ' 106' ' ' ILE . 32.2 mt -144.78 96.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.679 0.276 . . . . 0.0 111.18 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.3 p -52.72 149.63 5.97 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.786 0.327 . . . . 0.0 111.105 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -72.66 -50.93 21.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.808 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.14 160.45 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.988 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.15 76.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -178.36 -39.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.656 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.44 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -82.59 59.31 4.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.007 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.5 -71.9 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.227 -179.806 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.518 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -153.62 -41.25 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.579 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.85 -22.62 36.88 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.043 0.449 . . . . 0.0 110.199 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 81.6 mm-40 -85.94 -38.07 18.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.62 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.518 HD22 ' HA ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -77.05 -24.07 51.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.335 -179.12 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.56 ' HA ' ' HG ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.29 -26.57 7.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.182 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 123' ' ' PRO . . . -86.98 -35.16 19.0 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.239 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 14.3 tp -50.33 -46.65 55.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.894 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.486 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 20.5 m-85 -47.81 -70.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.51 ' CB ' ' HD3' ' A' ' 123' ' ' PRO . . . -103.46 -65.86 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.51 ' HD3' ' CB ' ' A' ' 122' ' ' ALA . 85.8 Cg_exo -45.85 154.48 0.69 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.344 2.029 . . . . 0.0 112.786 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -177.18 -177.19 0.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.067 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -102.78 39.7 1.49 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.831 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -93.14 155.01 22.14 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.452 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -171.25 36.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 110.937 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -176.34 149.49 0.84 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.912 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 1.3 m -136.4 31.38 2.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.912 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -149.94 163.34 38.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.846 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.095 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.474 -0.25 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.2 t -142.38 86.46 1.96 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.74 0.305 . . . . 0.0 110.925 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -131.37 -32.05 1.58 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.421 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.5 tpt 74.82 153.16 0.14 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.9 0.381 . . . . 0.0 110.754 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -88.14 -176.44 5.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.234 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.69 -40.19 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.628 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.42 HG21 ' CA ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER -114.26 141.45 47.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.392 179.714 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.485 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.01 145.91 31.7 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.276 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.9 p -96.18 126.43 41.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -109.89 150.68 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.109 0.481 . . . . 0.0 111.369 -178.872 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.4 p -136.98 131.14 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.682 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 6.7 m -98.39 104.59 16.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.436 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -104.6 106.71 17.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -130.27 146.48 51.88 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.086 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.47 84.42 2.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.145 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.3 mt -126.3 -61.71 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.762 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 18' ' ' GLU . 1.2 mttt -142.34 -83.08 0.19 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.517 0.199 . . . . 0.0 111.218 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' LYS . 8.5 pt-20 162.88 -16.97 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.915 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.78 46.44 1.08 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.835 -0.697 . . . . 0.0 111.944 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.422 ' CE2' ' HG3' ' A' ' 50' ' ' ARG . 2.9 t80 -101.66 27.6 6.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.914 0.388 . . . . 0.0 111.072 -179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 25' ' ' PHE . 7.2 mmt180 59.85 -177.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.409 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.402 ' HB2' ' HB3' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -171.23 -82.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.487 179.384 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -93.94 -43.01 8.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.365 0.602 . . . . 0.0 110.581 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 171.45 39.41 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.862 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.492 ' CE1' ' HB2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -165.02 -160.17 0.48 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.315 -0.443 . . . . 0.0 110.215 -179.171 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.45 78.97 1.91 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.725 0.298 . . . . 0.0 111.27 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.492 ' HB2' ' CE1' ' A' ' 25' ' ' PHE . 6.3 t80 -78.73 151.05 32.32 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.578 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.463 ' O ' ' N ' ' A' ' 30' ' ' GLY . 13.1 m170 -92.67 36.73 1.01 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.914 0.388 . . . . 0.0 110.274 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.9 mp 47.81 -86.14 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.34 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 28' ' ' HIS . . . 38.07 -136.48 0.92 Allowed Glycine 0 C--N 1.337 0.637 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.924 179.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.45 116.69 13.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.865 0.364 . . . . 0.0 111.043 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.557 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 42.4 t-20 -119.46 127.59 53.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.208 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.97 145.21 26.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.427 0.632 . . . . 0.0 111.576 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.629 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -111.15 141.8 44.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.841 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.611 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.69 156.72 39.12 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 120.998 0.428 . . . . 0.0 110.575 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.469 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -70.27 114.26 8.24 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.357 0.599 . . . . 0.0 111.32 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.462 ' CG2' ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -131.82 -170.81 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.936 -179.49 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.462 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 0.2 OUTLIER -66.67 -71.43 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -160.57 -18.15 0.05 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.6 p -42.85 -38.3 2.12 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.74 0.305 . . . . 0.0 111.813 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.538 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -58.56 -42.1 87.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.755 -179.735 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.505 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 5.4 tp -71.54 -30.3 65.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.415 -179.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.32 -27.97 20.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.588 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -69.82 -46.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.89 0.376 . . . . 0.0 110.637 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.442 HD11 ' CG1' ' A' ' 10' ' ' VAL . 65.7 mt -78.91 -31.57 45.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.176 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 42' ' ' LEU . 13.1 tttt -83.29 -15.7 49.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.298 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.51 -39.46 23.35 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.683 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -121.01 142.63 35.13 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -84.12 50.7 3.15 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.723 2.282 . . . . 0.0 112.522 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.422 ' HG3' ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -97.79 -49.69 4.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.536 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.43 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -125.26 -171.22 2.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.938 179.3 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.43 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 m -110.71 143.14 21.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 111.927 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.2 p -131.43 117.6 36.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.192 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.424 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -127.46 135.06 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.068 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.493 ' HA ' HG22 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -88.63 120.35 37.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.843 179.231 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 70.8 p -122.19 104.6 9.57 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.875 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -69.04 -63.41 1.07 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.885 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.1 p -103.31 132.15 49.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.86 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 170.15 -37.04 0.18 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.542 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.1 p -132.47 137.8 47.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.819 0.342 . . . . 0.0 110.857 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.99 164.29 12.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.889 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.3 177.21 8.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.855 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -143.66 -130.22 2.36 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.5 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -144.76 -88.83 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.459 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.75 -177.18 5.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.779 0.323 . . . . 0.0 110.857 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -142.46 105.99 0.43 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.533 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -125.26 30.6 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.797 0.332 . . . . 0.0 110.873 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -142.07 122.83 14.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.836 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp -77.05 99.33 5.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.871 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -173.79 91.56 0.35 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.926 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.9 103.7 0.9 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.528 2.152 . . . . 0.0 112.349 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -132.47 -46.1 0.9 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.102 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -170.3 -155.3 10.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.468 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.1 m 60.71 -178.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 110.892 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -108.11 162.3 14.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.869 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.6 179.72 5.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.834 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.99 96.0 3.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.851 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt 60.44 24.82 14.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.06 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 62.99 127.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.988 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mt -103.81 136.71 42.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -173.02 39.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.823 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -135.11 28.47 3.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.359 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.452 ' CB ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -90.67 -52.33 0.31 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.949 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.452 ' HD3' ' CB ' ' A' ' 83' ' ' ASP . 4.2 Cg_exo -77.16 113.72 3.65 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.849 2.366 . . . . 0.0 112.009 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -51.37 92.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.319 2.013 . . . . 0.0 112.3 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 59.6 p -129.41 157.02 43.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.043 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.6 t -178.81 131.1 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.867 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -150.33 -178.17 6.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.973 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.6 tp -120.84 -50.74 2.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.881 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -48.84 -30.39 5.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.741 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 t -62.05 -13.1 22.85 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.423 ' HB3' HD23 ' A' ' 97' ' ' LEU . 22.1 m-85 -108.06 159.87 16.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.633 0.254 . . . . 0.0 110.738 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 65.2 m -118.38 -97.86 0.46 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.609 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.548 ' HA ' ' CD1' ' A' ' 97' ' ' LEU . 21.2 t -139.05 -52.91 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.059 0 CA-C-O 121.198 0.523 . . . . 0.0 111.347 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -72.74 -19.85 61.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.8 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -80.68 -36.41 32.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 120.852 0.358 . . . . 0.0 110.893 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.688 HD21 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -63.32 -58.35 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.317 0.58 . . . . 0.0 109.981 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -55.06 -33.59 62.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.335 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.74 -22.01 29.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.066 0.46 . . . . 0.0 111.443 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.423 ' OE1' ' CE1' ' A' ' 92' ' ' PHE . 10.8 mt-30 -87.09 -36.8 17.93 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.524 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 9.0 mt -59.45 -48.68 80.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.199 0.523 . . . . 0.0 110.148 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -37.52 83.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.596 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.14 -6.57 59.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.265 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 -100.12 -15.22 18.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.169 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.55 -2.89 21.8 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.006 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.9 mt -109.93 78.38 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.909 0.385 . . . . 0.0 111.113 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.5 t -82.17 90.99 6.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.466 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -55.04 -177.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.107 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 9.9 mttm -148.46 -51.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.58 30.25 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.894 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -116.72 -37.48 3.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -100.99 99.86 10.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.886 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -80.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.241 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.527 ' HA ' HD22 ' A' ' 117' ' ' LEU . 8.3 ptmt -143.01 -38.9 0.34 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.734 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.05 -23.13 38.77 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -85.81 -36.86 19.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.755 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.674 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.0 -22.67 39.24 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.371 -179.419 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.688 ' HA ' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.41 -28.14 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.073 178.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.61 -33.17 18.94 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 121.209 0.528 . . . . 0.0 110.826 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.453 ' O ' ' N ' ' A' ' 122' ' ' ALA . 1.4 tm? -49.12 -51.21 33.32 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.692 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.536 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 40.8 m-85 -58.1 82.61 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.703 0.287 . . . . 0.0 110.982 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -148.35 160.31 37.06 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.233 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.68 -42.32 69.57 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.609 2.206 . . . . 0.0 112.157 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -172.47 112.07 0.26 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.203 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -107.18 32.94 4.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.965 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 83.23 -158.51 36.21 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.451 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 60.73 87.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.868 0.366 . . . . 0.0 110.784 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -95.52 74.4 3.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.022 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 3.1 m -111.06 178.0 4.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.795 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 59.58 30.16 19.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.949 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.254 -0.879 . . . . 0.0 111.034 179.932 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.4 t 60.72 36.53 19.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.846 0.355 . . . . 0.0 110.89 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -105.22 -178.01 3.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.961 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.15 -73.3 0.66 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.937 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.94 178.7 5.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.959 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.3 102.32 3.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.976 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.489 ' HB ' ' CB ' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -141.92 154.18 44.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.554 179.79 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.532 ' CE2' ' NE2' ' A' ' 41' ' ' GLN . 0.5 OUTLIER -144.79 143.53 30.7 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.557 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -89.36 125.12 35.0 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.873 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -110.31 149.11 13.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.364 0.602 . . . . 0.0 112.011 -178.395 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.5 p -138.6 126.67 28.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.452 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.409 ' CG1' ' CD1' ' A' ' 45' ' ' LEU . 16.9 m -93.82 104.69 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.549 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.88 106.56 18.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.427 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.445 ' HB2' ' CE2' ' A' ' 27' ' ' PHE . 1.8 t30 -105.15 146.45 29.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.07 0.462 . . . . 0.0 111.09 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 mtm180 -135.87 32.05 2.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.205 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.0 mp -97.92 -58.26 3.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.23 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.425 ' HD2' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -168.87 -170.1 1.11 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.801 0.334 . . . . 0.0 110.935 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.415 ' HB2' ' CD2' ' A' ' 28' ' ' HIS . 4.7 pt-20 -109.11 -16.05 14.19 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.137 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.5 44.03 1.59 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.131 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.425 ' CD1' ' HD2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -94.0 -1.72 54.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.576 0.226 . . . . 0.0 111.275 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 60.6 -175.46 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.026 0.441 . . . . 0.0 111.29 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.92 -162.84 0.15 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.616 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -44.76 -30.03 0.88 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.991 0.424 . . . . 0.0 111.375 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 147.24 39.95 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.314 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.419 ' CD1' ' N ' ' A' ' 25' ' ' PHE . 4.3 m-85 -135.98 23.84 3.31 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.485 0.18 . . . . 0.0 111.485 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 43.72 61.18 2.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.947 0.404 . . . . 0.0 111.123 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.445 ' CE2' ' HB2' ' A' ' 14' ' ' ASN . 3.4 t80 -56.97 112.6 1.38 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.159 -179.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.415 ' CD2' ' HB2' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -82.22 -172.33 3.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.774 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.427 ' HA ' HD22 ' A' ' 29' ' ' LEU . 2.3 tm? -80.57 102.81 10.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.16 0.505 . . . . 0.0 110.177 179.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.19 -139.88 6.23 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.205 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.3 p-10 -143.08 143.93 32.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.921 0.391 . . . . 0.0 111.297 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.8 m-20 -119.16 137.86 53.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.079 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.19 145.08 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.359 0.599 . . . . 0.0 111.484 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.656 ' CD1' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -115.07 143.4 45.25 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.93 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.656 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.33 157.38 37.84 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 121.179 0.514 . . . . 0.0 111.044 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.489 ' CB ' ' HB ' ' A' ' 7' ' ' THR . . . -69.56 111.34 5.32 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.686 0.755 . . . . 0.0 111.987 -177.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 t -129.93 179.67 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.489 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.79 72.61 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.508 ' HA ' ' NE2' ' A' ' 41' ' ' GLN . 0.4 OUTLIER 78.52 -16.65 0.65 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 178.396 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 t -62.58 -21.37 65.56 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -84.61 -25.77 28.35 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.376 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 46' ' ' LYS . 7.5 tp -74.36 -54.72 7.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.96 0.41 . . . . 0.0 110.977 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.63 -21.48 66.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.184 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -48.38 21.61 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.426 HD11 ' CG1' ' A' ' 10' ' ' VAL . 59.1 mt -78.83 -30.75 45.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.284 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -77.28 -10.26 59.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.373 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.69 -47.94 29.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.794 0.331 . . . . 0.0 111.44 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.5 123.08 64.8 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -80.6 55.28 5.61 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.579 2.186 . . . . 0.0 112.455 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.417 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -135.58 -43.07 0.68 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 -179.925 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.97 -176.5 4.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.479 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.52 108.83 19.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.775 0.321 . . . . 0.0 111.599 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.8 p -98.93 111.77 29.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.195 0.521 . . . . 0.0 110.295 179.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -127.04 144.66 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.295 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.545 ' HA ' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -100.03 133.13 44.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.353 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m -122.4 104.66 9.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.782 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -91.86 -64.73 1.08 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.3 m -67.69 -55.87 11.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.95 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 131.72 93.55 0.59 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.1 t -91.21 161.27 15.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.77 0.319 . . . . 0.0 110.967 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -150.7 -46.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.898 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -158.73 179.86 8.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.858 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -149.3 -68.87 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.523 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.56 27.97 71.76 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.535 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.88 79.28 0.47 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.855 0.359 . . . . 0.0 110.899 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.18 159.22 32.29 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.467 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.52 -31.58 72.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 110.914 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.45 87.77 0.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.962 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -128.84 6.75 5.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.415 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 59.82 159.5 0.1 Allowed Pre-proline 0 C--N 1.332 -0.162 0 CA-C-O 120.792 0.329 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.95 125.76 19.79 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.568 2.179 . . . . 0.0 112.285 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -168.0 -48.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.106 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -103.27 76.15 0.29 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.482 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.7 m -96.72 42.91 1.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.78 0.324 . . . . 0.0 110.861 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.39 103.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.825 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.5 109.24 10.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.879 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -111.05 126.17 54.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.931 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -155.07 82.98 1.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -86.84 104.79 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.023 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.0 pp -176.33 126.45 0.19 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.905 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -99.26 152.66 19.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.927 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.79 157.3 19.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.121 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.412 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -178.51 -61.54 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.886 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.412 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 59.6 Cg_endo -72.45 109.97 2.87 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.528 2.152 . . . . 0.0 112.347 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.16 174.76 8.52 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.427 2.085 . . . . 0.0 112.309 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.2 m -155.61 126.82 7.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.937 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.61 -71.81 0.2 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.901 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -174.07 -49.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.964 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.86 -33.94 4.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.971 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -48.82 -41.79 34.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.341 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.87 -13.78 27.68 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.439 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 6.2 m-85 -106.29 104.53 14.25 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.437 ' O ' HD21 ' A' ' 97' ' ' LEU . 66.5 p -89.44 -85.54 0.2 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.997 -178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.598 ' HA ' HD23 ' A' ' 97' ' ' LEU . 24.2 t -145.5 -56.52 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.957 0.408 . . . . 0.0 111.309 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -73.44 -19.25 61.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.005 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -81.99 -20.8 37.76 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.734 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.686 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -78.5 -58.27 3.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -55.34 -29.66 58.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.345 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.81 -30.32 24.65 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.064 0.459 . . . . 0.0 112.022 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.429 ' HB2' ' CZ ' ' A' ' 121' ' ' PHE . 3.9 mm-40 -86.5 -22.02 26.64 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.696 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.513 ' HG ' ' CE1' ' A' ' 121' ' ' PHE . 1.2 mt -76.87 -42.2 40.81 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.333 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -43.39 94.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.377 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -6.33 53.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.176 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 104' ' ' ARG . 0.7 OUTLIER -108.56 -15.46 14.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.153 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.513 ' O ' ' CG2' ' A' ' 106' ' ' ILE . . . 144.25 -54.6 0.57 Allowed Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.179 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.513 ' CG2' ' O ' ' A' ' 105' ' ' GLY . 9.4 tp 52.27 136.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-O 121.457 0.646 . . . . 0.0 112.725 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 18.1 p -156.36 26.68 0.35 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.545 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.478 ' CZ ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.82 87.52 0.14 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.644 -179.535 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -67.14 70.9 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 51.28 27.3 3.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.6 p -117.43 -29.23 5.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.268 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.485 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -85.22 76.05 10.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.81 0.338 . . . . 0.0 111.386 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -70.59 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.983 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.1 mttp -154.09 -42.24 0.09 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.73 0.3 . . . . 0.0 111.477 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.29 -23.9 40.39 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.926 0.393 . . . . 0.0 110.143 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.8 mt-10 -85.97 -37.37 19.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.452 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.578 HD22 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -77.88 -19.82 54.1 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.913 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.578 ' N ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -82.85 -27.85 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.997 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.3 -34.74 18.77 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.84 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.461 ' O ' ' N ' ' A' ' 122' ' ' ALA . 1.2 tp -49.9 -40.43 42.97 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.447 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.513 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 6.0 m-85 -51.58 86.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.287 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -117.25 140.22 26.95 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.132 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.41 121.81 10.13 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.416 2.077 . . . . 0.0 112.352 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -120.03 -62.8 1.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.105 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -85.09 176.97 8.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.901 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -66.25 -168.58 2.85 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.536 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -102.5 149.61 24.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.74 0.305 . . . . 0.0 110.926 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.55 136.65 32.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.997 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 12.1 t -131.96 -47.08 0.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -126.69 -56.68 1.37 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.859 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.211 -0.899 . . . . 0.0 111.096 179.967 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m 60.45 -176.31 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.886 0.374 . . . . 0.0 110.881 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -142.5 127.72 18.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.956 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.1 ptt? -101.8 31.6 3.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.851 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -163.6 -173.72 3.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.829 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.27 40.56 17.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.409 HG23 ' N ' ' A' ' 37' ' ' VAL . 0.0 OUTLIER -162.51 132.05 4.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.646 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.505 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.23 144.67 30.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.366 0.603 . . . . 0.0 112.619 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.69 130.06 36.02 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.638 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.24 152.61 12.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 112.079 -178.557 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.5 p -138.47 102.1 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.316 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.413 HG23 ' CD2' ' A' ' 45' ' ' LEU . 42.9 t -92.49 130.25 41.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.18 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.422 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 28.3 tt0 -125.0 106.62 10.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.866 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -96.64 146.57 24.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.694 179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.74 38.4 4.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.234 0.54 . . . . 0.0 110.142 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.414 ' N ' HD23 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -146.83 139.41 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.315 -179.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.43 -163.86 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.135 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -96.44 63.63 2.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.557 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.411 ' HA3' ' C ' ' A' ' 27' ' ' PHE . . . 93.84 -34.82 4.44 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.027 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 77.48 39.97 0.17 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.821 0.343 . . . . 0.0 111.004 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 60.24 -175.84 0.11 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.434 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.421 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -172.88 -162.65 0.18 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.822 179.566 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.27 -19.3 13.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.47 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 150.08 -12.56 0.95 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.567 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -77.09 -6.04 51.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.658 0.266 . . . . 0.0 111.198 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.41 ' O ' ' CE1' ' A' ' 28' ' ' HIS . 0.6 OUTLIER 62.49 73.81 0.45 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.039 0.447 . . . . 0.0 110.845 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.422 ' CZ ' ' HB2' ' A' ' 32' ' ' ASN . 4.4 t80 -55.94 157.45 4.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.594 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.41 ' CE1' ' O ' ' A' ' 26' ' ' SER . 65.4 m80 -129.63 167.62 17.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.814 0.34 . . . . 0.0 110.977 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.414 HD23 ' N ' ' A' ' 16' ' ' ILE . 0.4 OUTLIER -67.55 103.57 1.38 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.252 0.549 . . . . 0.0 110.477 179.252 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.422 ' O ' ' HA ' ' A' ' 13' ' ' GLN . . . 170.76 -140.51 6.01 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.108 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -138.9 131.63 29.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.768 0.318 . . . . 0.0 111.02 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.422 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 10.1 m-20 -126.38 131.78 51.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.236 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.4 m -87.22 145.76 26.26 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.167 0.508 . . . . 0.0 111.162 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.628 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -115.34 141.16 48.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.118 -179.847 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.623 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.67 157.3 38.23 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.9 0.381 . . . . 0.0 110.219 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.425 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -69.2 114.58 7.59 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.742 0.782 . . . . 0.0 111.352 -177.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.409 ' N ' HG23 ' A' ' 7' ' ' THR . 11.1 t -127.79 167.91 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.775 -179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.39 -53.71 47.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.595 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.74 -20.62 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.38 -33.1 0.6 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.825 0.345 . . . . 0.0 111.473 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.608 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.1 -57.85 11.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.771 179.618 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.41 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 8.8 tp -53.05 -55.47 23.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.874 -178.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.33 -30.94 70.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.489 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -53.08 -54.62 32.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.364 . . . . 0.0 110.661 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.413 ' CD2' HG23 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -79.07 -54.45 5.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.062 179.783 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -49.26 -25.94 2.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.511 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.19 -30.2 1.13 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.541 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -112.5 121.73 38.17 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.774 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -77.19 69.58 7.05 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.468 2.112 . . . . 0.0 112.266 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.35 -40.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.173 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.22 124.45 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.754 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.5 t -69.7 106.11 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.999 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.0 p -107.13 117.73 53.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.703 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.408 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.07 142.96 51.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.084 -178.665 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.555 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.2 pt -93.8 126.78 46.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.28 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t -122.28 104.59 9.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.59 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.417 ' O ' ' CG2' ' A' ' 58' ' ' THR . 2.5 pm0 -84.54 -59.64 2.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.574 -179.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.417 ' CG2' ' O ' ' A' ' 57' ' ' GLU . 12.8 t 47.25 -171.26 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.79 0.329 . . . . 0.0 111.298 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -114.12 141.47 17.0 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.667 -0.777 . . . . 0.0 112.57 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.4 m -71.53 95.24 1.38 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.869 0.366 . . . . 0.0 110.927 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -114.01 -37.34 4.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.866 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -92.96 140.26 29.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.89 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -98.01 146.46 18.22 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.493 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -131.52 154.24 20.8 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.517 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -133.46 30.79 3.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.851 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 170.54 171.03 35.51 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.425 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.61 -61.36 1.39 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.801 0.334 . . . . 0.0 110.859 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -175.63 -55.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.04 143.54 23.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -57.88 109.42 1.78 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.988 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.65 135.73 24.44 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.516 2.144 . . . . 0.0 112.312 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.91 -63.81 1.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.069 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -155.05 -162.77 11.49 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.451 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.85 -34.05 34.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.783 0.325 . . . . 0.0 110.87 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -174.8 -41.01 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -156.02 98.56 1.9 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.911 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -140.5 -177.19 4.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.26 175.5 6.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.954 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -107.63 -159.26 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.71 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.6 mt 66.02 41.75 3.53 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.808 0.337 . . . . 0.0 110.969 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.1 mtm-85 62.69 132.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.085 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -98.75 -30.79 12.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.025 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -92.46 112.64 56.39 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.848 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.482 ' N ' ' CD ' ' A' ' 85' ' ' PRO . 44.1 Cg_exo -55.33 -45.08 42.81 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.372 2.048 . . . . 0.0 112.564 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' A' ' 84' ' ' PRO . 47.2 Cg_exo -56.11 123.24 13.35 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.362 2.041 . . . . 0.0 112.188 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 21.3 t -161.97 85.76 0.61 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.935 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.4 m -145.09 87.79 1.85 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 62.04 34.99 16.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.026 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 3.0 mm? -110.09 -27.11 9.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.058 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -54.62 -50.28 68.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.332 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.8 m -62.41 -14.63 42.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 89' ' ' LEU . 4.3 m-85 -71.75 -14.45 62.01 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 122.24 -0.287 . . . . 0.0 111.26 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.431 ' O ' ' CG1' ' A' ' 118' ' ' ILE . 0.2 OUTLIER 57.74 -148.72 0.48 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.968 179.293 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.705 ' HA ' HD22 ' A' ' 97' ' ' LEU . 4.0 m -127.44 -32.08 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.166 0.508 . . . . 0.0 110.993 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.6 -19.55 38.18 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -23.6 40.13 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.823 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.705 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -84.78 -48.92 8.91 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.18 179.8 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.44 ' H ' HD21 ' A' ' 97' ' ' LEU . 0.8 OUTLIER -57.89 -35.67 71.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.611 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.16 -23.97 28.15 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.481 ' HG2' ' CE1' ' A' ' 121' ' ' PHE . 1.0 OUTLIER -86.52 -37.89 17.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.664 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.471 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 1.9 mt -59.34 -46.98 87.13 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.454 HG21 ' CE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -59.93 -43.08 95.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.961 179.297 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -72.62 -6.78 46.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.051 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -105.98 -15.43 14.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.87 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 63.05 63.85 4.25 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.725 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.5 mm -116.59 -86.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.587 0.194 . . . . 0.0 111.109 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.3 t 169.88 150.13 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.454 ' CE1' HG21 ' A' ' 102' ' ' THR . 13.4 p90 -171.89 92.27 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.971 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -176.79 135.4 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.883 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 68.84 -67.11 0.22 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.873 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.3 p -65.88 -68.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.71 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -79.98 179.56 7.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.965 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -172.34 -80.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.749 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.21 -57.49 0.65 Allowed 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.422 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.71 -35.03 79.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.148 0.499 . . . . 0.0 109.954 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -86.84 -33.95 19.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.756 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.439 ' CD2' ' HE3' ' A' ' 98' ' ' LYS . 1.7 tp -74.67 -37.47 62.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.896 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.635 ' HA ' ' HG ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -77.56 -28.31 15.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.101 179.651 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.75 -32.5 20.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 121.077 0.465 . . . . 0.0 110.872 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.7 mt -54.98 -40.36 69.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.641 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.541 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.4 m-85 -51.5 -41.08 60.71 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.676 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -129.78 85.94 56.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.427 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.25 -27.61 7.92 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.599 2.199 . . . . 0.0 112.077 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -169.87 -42.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.956 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.21 44.6 9.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.989 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 75.04 -171.53 53.86 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.542 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.41 100.03 5.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.829 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.5 tttt 60.87 176.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.869 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 3.0 t 68.93 -67.28 0.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.959 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -101.44 153.51 19.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.907 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.205 -0.903 . . . . 0.0 111.145 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.28 103.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.825 0.345 . . . . 0.0 110.857 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -139.47 -47.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 36.9 mmt -104.95 -30.58 9.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.917 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -79.3 155.77 28.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.099 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -149.65 83.79 1.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.884 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.428 ' HB ' ' CB ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -139.09 139.49 37.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.785 -179.839 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.492 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.07 137.12 25.77 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.7 p -87.91 124.41 33.65 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.629 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.02 157.72 10.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 CA-C-O 120.923 0.392 . . . . 0.0 111.385 -178.625 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 1.4 p -138.51 108.97 4.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.112 0.482 . . . . 0.0 110.537 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.449 ' CG2' ' CD1' ' A' ' 45' ' ' LEU . 2.5 t -92.68 135.9 26.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.23 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -116.72 113.34 22.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.757 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.59 137.38 35.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.039 0.447 . . . . 0.0 110.951 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -135.72 29.74 3.18 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.215 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mp -107.08 -60.05 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.389 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -148.38 -175.49 4.93 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.739 0.304 . . . . 0.0 110.911 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -109.81 0.68 18.9 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.984 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -141.78 44.81 0.98 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.827 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.566 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 4.8 t80 -86.96 56.84 4.19 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.063 0.458 . . . . 0.0 110.264 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 41.58 110.48 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.893 -1.048 . . . . 0.0 112.856 179.074 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.435 ' CA ' ' HB3' ' A' ' 26' ' ' SER . 0.4 OUTLIER -58.5 -156.06 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.215 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 22' ' ' ARG . . . 79.12 28.93 0.37 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.983 0.421 . . . . 0.0 110.41 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 102.81 34.31 4.1 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.521 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.455 ' HB2' ' O ' ' A' ' 21' ' ' ARG . 56.3 m-85 -155.84 -70.93 0.11 Allowed 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.513 ' HB2' ' C ' ' A' ' 20' ' ' TYR . 38.4 t -54.37 -94.23 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.619 0.247 . . . . 0.0 111.326 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 55.15 26.03 7.86 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.721 0.296 . . . . 0.0 110.954 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.52 176.84 0.14 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.63 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 15.7 mt -82.35 101.02 10.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.163 0.506 . . . . 0.0 110.831 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 175.05 -141.03 5.58 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.178 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -128.58 127.01 41.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.773 0.321 . . . . 0.0 110.961 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -114.73 123.39 49.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.848 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -87.44 145.73 26.15 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.331 0.586 . . . . 0.0 111.629 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.629 ' N ' ' O ' ' A' ' 10' ' ' VAL . 0.5 OUTLIER -114.91 139.08 50.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.945 179.671 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.557 ' O ' ' CD1' ' A' ' 34' ' ' LEU . . . -70.8 156.4 39.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 8' ' ' PHE . . . -70.63 116.73 11.29 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.415 0.626 . . . . 0.0 111.384 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.431 ' CG2' ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -130.19 -171.69 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.849 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.431 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 44.3 p -59.77 -58.63 7.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.172 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 179.88 -16.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.4 t -42.54 -34.76 0.91 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.569 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -58.9 -48.75 80.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.843 0.354 . . . . 0.0 111.356 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.452 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 9.3 tp -55.55 -50.11 70.91 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.406 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.25 -29.67 54.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.444 -179.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -58.59 -46.57 86.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.119 0.485 . . . . 0.0 110.15 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.449 ' CD1' ' CG2' ' A' ' 12' ' ' VAL . 4.5 mt -78.95 -48.15 15.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.704 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -64.12 -16.72 62.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.291 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.53 -41.94 14.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.807 0.337 . . . . 0.0 111.462 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.4 ' HB2' ' CE1' ' A' ' 25' ' ' PHE . 0.6 OUTLIER -101.83 121.37 51.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.84 179.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.54 62.6 6.33 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.57 2.18 . . . . 0.0 112.3 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.78 -46.14 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 44.6 mt -92.26 144.49 25.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.993 0.425 . . . . 0.0 111.187 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.69 108.18 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.935 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.434 ' HB ' ' HB2' ' A' ' 45' ' ' LEU . 1.3 p -104.66 121.39 56.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.971 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.468 ' O ' HG23 ' A' ' 10' ' ' VAL . 9.0 pm0 -126.92 133.39 50.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.635 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.555 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -97.98 131.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.446 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.3 m -122.38 104.53 9.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.459 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -84.76 -79.32 0.22 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.104 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.77 113.14 16.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.961 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -107.37 40.09 2.65 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.407 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 26.1 m 61.02 76.21 0.38 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.789 0.328 . . . . 0.0 110.944 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -176.01 116.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.826 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.13 129.99 45.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 92.22 -148.37 19.13 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.53 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -148.91 48.23 0.61 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.466 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -64.08 152.91 39.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.806 0.336 . . . . 0.0 110.905 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 119.27 -56.68 0.57 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.419 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.3 mt -92.8 124.93 37.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 110.906 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.9 p -101.89 157.0 17.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.88 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.94 -49.11 6.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.869 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.25 152.36 84.83 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.912 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.67 128.93 16.82 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.59 2.193 . . . . 0.0 112.327 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -144.46 -57.58 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.101 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 67.04 99.95 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.508 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.72 124.1 20.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.8 0.334 . . . . 0.0 110.921 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -106.34 69.5 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -159.48 107.32 1.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -115.68 161.97 17.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.878 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -157.27 -46.82 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.93 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.95 164.82 11.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.817 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -158.44 32.34 0.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.926 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.23 70.76 0.1 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.9 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.89 105.46 0.32 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.158 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -161.31 87.8 1.63 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.854 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -51.65 139.32 48.3 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.479 2.119 . . . . 0.0 112.277 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -73.65 157.46 48.4 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.448 2.099 . . . . 0.0 112.321 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.8 p -77.52 141.77 39.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.908 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.0 t 45.41 -167.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.319 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 68.45 -69.0 0.16 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.943 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.34 -16.91 61.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.203 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -49.06 -50.29 37.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.393 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 t -62.19 -15.08 44.09 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.44 ' C ' HD13 ' A' ' 97' ' ' LEU . 61.9 m-85 -114.22 103.5 11.16 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.697 0.284 . . . . 0.0 110.29 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.435 ' N ' HD13 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -94.55 -80.87 0.4 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.593 -179.579 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.651 ' HA ' HD23 ' A' ' 97' ' ' LEU . 28.1 t -147.33 -56.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.81 0.338 . . . . 0.0 111.302 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -19.59 60.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.981 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.434 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -82.65 -21.28 35.05 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.514 -179.362 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -75.6 -58.47 3.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -57.12 -29.13 63.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.29 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.9 23.95 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.434 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 7.3 mm-40 -84.17 -28.01 27.67 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.216 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.478 ' HG ' ' CE1' ' A' ' 121' ' ' PHE . 1.1 mt -69.78 -45.73 67.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.849 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.486 ' HA ' ' HB ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -57.33 -45.29 84.4 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.373 179.541 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -75.52 -6.32 49.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.413 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -114.76 24.17 12.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.599 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.61 -32.09 6.87 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.743 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.486 ' HB ' ' HA ' ' A' ' 102' ' ' THR . 0.5 OUTLIER 43.9 96.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 112.106 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -118.16 28.23 8.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.512 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.437 ' CZ ' HD12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -69.34 -177.74 1.21 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.096 -179.79 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.43 165.91 12.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.96 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -26.12 42.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.943 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -82.58 0.89 40.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.387 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.82 77.53 0.08 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.785 0.326 . . . . 0.0 111.005 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 70.5 p -77.05 -79.75 0.11 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.979 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.578 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.1 pptp? -146.55 -39.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.667 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.82 -23.75 38.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.94 0.4 . . . . 0.0 110.714 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -85.92 -37.2 19.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.502 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.614 HD22 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.65 -19.33 41.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.947 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.614 ' N ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.48 -26.27 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.101 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.52 -34.31 20.04 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.819 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.98 -41.57 64.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.077 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.478 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 4.6 m-85 -48.21 -59.22 3.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.42 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 61.39 163.42 0.11 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.089 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.59 167.76 1.92 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.596 2.197 . . . . 0.0 112.441 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -169.13 136.99 1.9 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.006 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -107.07 -67.51 0.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.082 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -145.63 -143.94 4.03 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.591 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -125.78 151.68 46.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.819 0.342 . . . . 0.0 110.944 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -168.43 -46.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.823 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.45 -39.05 3.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.875 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.09 107.44 5.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.878 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.132 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.811 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 6.3 t . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.739 0.304 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.82 152.99 38.59 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -98.88 122.93 42.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.727 HG11 HD12 ' A' ' 45' ' ' LEU . 0.4 OUTLIER -110.22 155.63 11.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.007 0.432 . . . . 0.0 111.873 -178.47 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -135.71 134.91 51.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.113 0.482 . . . . 0.0 111.201 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.811 HG13 HD13 ' A' ' 45' ' ' LEU . 14.1 m -102.36 107.52 22.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.039 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.72 106.46 18.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.563 ' CG ' HD12 ' A' ' 51' ' ' LEU . 53.8 t30 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.371 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.872 0.368 . . . . 0.0 111.01 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.557 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.7 t-20 -116.36 130.53 56.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.1 m -86.96 145.14 26.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.455 0.645 . . . . 0.0 111.625 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.942 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.41 142.14 44.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.865 179.717 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.942 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.34 157.56 37.53 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.11 0.481 . . . . 0.0 110.773 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.811 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -69.2 105.15 2.4 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.764 0.792 . . . . 0.0 111.095 -177.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 35' ' ' ALA . 5.6 t -123.66 166.48 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.047 0 CA-C-N 114.205 -1.362 . . . . 0.0 110.617 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.491 ' N ' HG12 ' A' ' 37' ' ' VAL . 11.3 t -52.09 -73.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.351 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -156.5 -16.69 0.1 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -43.03 -45.88 5.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.879 0.371 . . . . 0.0 111.408 -179.851 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.627 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -44.24 -60.92 1.69 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.204 179.562 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD13 HG23 ' A' ' 55' ' ' ILE . 11.4 tp -52.01 -55.38 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.784 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -35.07 79.08 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' SER . 2.6 tp60 -68.2 -41.8 80.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.852 0.358 . . . . 0.0 111.061 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.811 HD13 HG13 ' A' ' 12' ' ' VAL . 68.2 mt -78.74 -31.24 46.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.61 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -79.64 -29.8 41.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 110.865 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.53 -29.7 59.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.185 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -93.19 110.15 44.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.764 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.85 58.78 6.62 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.514 2.143 . . . . 0.0 112.418 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.59 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER -140.97 -45.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.59 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.2 OUTLIER -107.75 175.35 5.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.545 179.796 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.604 ' O ' HG12 ' A' ' 12' ' ' VAL . 2.9 m -110.67 146.04 16.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.96 0.41 . . . . 0.0 111.984 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.457 HG21 ' HA ' ' A' ' 42' ' ' LEU . 3.2 p -130.82 116.32 33.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.818 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.644 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.0 mm-40 -127.47 131.43 50.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.48 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.633 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.8 pt -88.75 132.3 33.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.586 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 39.1 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.489 179.518 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.5 tp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.898 0.38 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -44.09 41.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.556 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.88 -14.87 38.01 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -93.66 104.19 16.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.825 0.345 . . . . 0.0 110.521 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.523 HG22 HG23 ' A' ' 94' ' ' VAL . 68.0 m -79.94 -97.61 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.458 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.623 ' HA ' HD11 ' A' ' 97' ' ' LEU . 20.5 t -142.89 -41.85 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.942 0.401 . . . . 0.0 111.246 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -77.77 -20.88 52.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.618 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.89 -51.01 24.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.221 0.534 . . . . 0.0 109.912 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.657 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -50.86 -58.3 6.32 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.904 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.554 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 3.4 ptpt -56.87 -33.31 66.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.727 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.1 -24.15 28.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.982 0.42 . . . . 0.0 112.004 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.478 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 1.3 tp60 -87.09 -37.8 17.08 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.589 HD11 HD22 ' A' ' 120' ' ' LEU . 1.2 mt -60.07 -46.94 87.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.033 0.444 . . . . 0.0 110.081 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -39.83 90.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.179 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.12 -6.58 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.125 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -101.75 -15.34 17.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.14 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.29 39.2 3.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.58 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.443 ' HB ' HD22 ' A' ' 101' ' ' LEU . 29.6 mt -141.58 85.08 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.762 0.315 . . . . 0.0 111.169 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.6 t -62.08 157.92 17.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.823 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.0 p90 -152.39 101.13 2.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.971 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.51 -52.49 2.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.823 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -83.16 -59.1 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.767 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.1 t -88.08 -167.83 2.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.717 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.823 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . 54.65 48.71 19.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.031 0.444 . . . . 0.0 111.087 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.32 -70.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.657 ' HE3' ' HB2' ' A' ' 115' ' ' ALA . 0.0 OUTLIER -157.53 -39.87 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.328 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.657 ' HB2' ' HE3' ' A' ' 114' ' ' LYS . . . -83.12 -21.47 33.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.003 0.43 . . . . 0.0 109.993 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 9.5 mm-40 -85.84 -38.79 17.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.658 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.804 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -78.06 -20.14 52.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.611 -0.435 . . . . 0.0 111.524 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.804 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -28.0 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.779 177.915 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.58 -31.81 19.66 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.18 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.589 HD22 HD11 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -49.05 -53.11 21.71 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.147 -178.751 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.556 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 88.5 m-85 . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 111.416 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.902 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 2.0 t . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 120.523 0.202 . . . . 0.0 110.813 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.56 ' CE2' ' HB ' ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.52 145.61 30.22 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.0 p -123.56 121.19 35.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.944 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.874 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.75 152.43 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 111.915 -178.532 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.6 p -127.43 137.31 58.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.68 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.749 ' CG1' HD13 ' A' ' 45' ' ' LEU . 15.7 m -110.78 104.65 17.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -90.66 106.33 18.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.748 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 121.026 0.441 . . . . 0.0 111.535 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.434 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.893 0.377 . . . . 0.0 111.329 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.503 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 2.3 t-20 -124.06 138.27 54.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.08 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.07 145.05 26.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.361 0.601 . . . . 0.0 111.511 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.959 HD22 ' H ' ' A' ' 35' ' ' ALA . 1.6 tm? -101.29 150.91 22.5 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.643 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.959 ' H ' HD22 ' A' ' 34' ' ' LEU . . . -70.73 156.64 39.25 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 121.742 0.782 . . . . 0.0 112.828 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.902 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.18 105.02 3.26 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.924 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.703 ' O ' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -123.46 -170.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.955 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.613 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.8 p -85.66 43.01 1.0 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.809 ' OE1' HD23 ' A' ' 42' ' ' LEU . 0.0 OUTLIER 79.23 -16.51 0.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.069 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -44.85 -34.15 2.23 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.125 0.488 . . . . 0.0 110.586 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.582 ' OE1' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -56.99 -44.24 82.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.258 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.809 HD23 ' OE1' ' A' ' 39' ' ' GLU . 13.9 tp -56.46 -55.63 31.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.147 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -26.18 55.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.557 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -49.4 75.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.821 0.343 . . . . 0.0 110.594 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.77 HD12 HG11 ' A' ' 10' ' ' VAL . 11.4 mt -79.06 -46.55 17.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.545 ' CA ' HG11 ' A' ' 53' ' ' VAL . 1.7 tttp -54.93 -22.56 15.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.346 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.01 -70.77 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.639 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -64.07 117.2 33.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.858 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -80.57 87.27 1.53 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.509 2.14 . . . . 0.0 112.546 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -168.15 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.917 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.627 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -93.87 174.85 6.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.505 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -115.91 106.86 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.279 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.545 HG11 ' CA ' ' A' ' 46' ' ' LYS . 2.1 p -99.02 115.71 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.54 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.656 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.8 tp60 -108.77 130.36 55.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.823 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.874 HG22 HG23 ' A' ' 10' ' ' VAL . 1.3 pp -107.64 105.48 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.721 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.761 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.905 HD21 HG12 ' A' ' 118' ' ' ILE . 18.9 tp . . . . . 0 CA--C 1.527 0.087 0 CA-C-O 120.765 0.317 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -49.04 -47.6 44.55 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.532 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.08 -13.06 22.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.691 ' HB2' HD12 ' A' ' 89' ' ' LEU . 42.9 m-85 -94.66 -20.9 19.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 120.644 0.259 . . . . 0.0 111.18 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.772 ' O ' HD21 ' A' ' 97' ' ' LEU . 1.6 p 61.13 -147.92 0.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.953 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.684 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.5 t -120.34 -54.92 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.073 0 CA-C-O 121.012 0.434 . . . . 0.0 111.512 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -65.08 -19.96 66.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.971 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.7 OUTLIER -76.33 -37.88 56.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 120.774 0.321 . . . . 0.0 110.784 -178.921 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 1.006 HD11 HD12 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -64.04 -58.5 6.49 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.766 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HD2' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -54.23 -35.07 62.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.976 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.03 -23.66 28.51 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.43 ' O ' ' N ' ' A' ' 104' ' ' ARG . 6.2 mm-40 -86.78 -39.96 15.44 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.666 HD13 HG21 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -55.94 -48.78 75.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.194 0.521 . . . . 0.0 109.945 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.553 HG23 ' CD1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -64.03 -40.59 96.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.422 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -80.38 -6.35 57.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.433 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.495 ' HB3' HD13 ' A' ' 106' ' ' ILE . 5.0 ttt180 -97.87 -15.45 20.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.307 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 108.62 15.08 14.15 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.274 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.666 HG21 HD13 ' A' ' 101' ' ' LEU . 2.8 mp -96.3 -30.88 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.111 0.456 . . . . 0.0 110.758 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.7 p 47.29 28.54 1.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.614 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.553 ' CD1' HG23 ' A' ' 102' ' ' THR . 1.1 m-85 60.62 -174.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.525 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.47 ' N ' ' HB3' ' A' ' 112' ' ' ALA . 4.9 mmtp -177.46 173.82 1.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.889 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -31.06 60.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.82 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.32 -29.94 14.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.643 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.47 ' HB3' ' N ' ' A' ' 109' ' ' LYS . . . -80.99 58.82 3.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.06 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -70.69 -66.51 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.445 ' HA ' HD21 ' A' ' 117' ' ' LEU . 10.4 ptpp? -159.0 -45.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.61 -21.64 59.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.912 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 64.1 mm-40 -85.16 -37.52 20.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.997 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.91 HD12 ' N ' ' A' ' 118' ' ' ILE . 4.0 pp -71.23 -38.03 71.98 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.001 0.429 . . . . 0.0 110.382 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 1.006 HD12 HD11 ' A' ' 97' ' ' LEU . 1.7 tt -70.03 -26.56 30.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.121 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.92 -33.47 19.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.077 0.465 . . . . 0.0 111.173 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.16 -36.0 82.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.839 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 5.8 m-85 . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.913 0.387 . . . . 0.0 111.277 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.744 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 6.4 t . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.867 0.365 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.524 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.87 153.66 39.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.546 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 18.6 p -92.38 124.86 36.74 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.655 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 154.25 11.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.044 0.449 . . . . 0.0 111.334 -178.591 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.796 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.26 128.56 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 121.095 0.474 . . . . 0.0 112.035 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.017 HG13 HD13 ' A' ' 45' ' ' LEU . 1.7 m -96.92 104.53 15.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.773 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -107.96 106.58 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.621 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 m120 . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.938 179.924 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 121.186 0.517 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.796 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 t-20 -122.05 127.89 50.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.473 -0.785 . . . . 0.0 108.926 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 p -86.43 145.46 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.718 0.771 . . . . 0.0 112.653 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.915 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -122.09 141.33 51.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.149 179.852 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.915 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -71.16 155.92 40.18 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.141 0.496 . . . . 0.0 110.923 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.744 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.13 109.88 5.47 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.418 0.627 . . . . 0.0 111.838 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 38' ' ' SER . 0.7 OUTLIER -129.13 179.42 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.809 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.65 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.6 OUTLIER -51.22 -83.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.303 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -148.02 -16.57 0.35 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.52 -47.31 5.1 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.626 ' HG3' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -52.23 -27.69 15.75 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.0 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.44 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.3 tp -81.81 -39.8 23.48 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.843 0.354 . . . . 0.0 110.846 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -83.3 -21.46 33.23 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.422 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -70.5 -49.96 42.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 110.563 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 1.017 HD13 HG13 ' A' ' 12' ' ' VAL . 35.5 mt -78.79 -36.64 42.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.947 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.555 ' N ' HG11 ' A' ' 53' ' ' VAL . 7.4 tttm -67.37 -28.57 68.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.863 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -48.79 -28.3 3.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.228 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -101.97 104.41 35.75 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.761 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.78 66.43 4.86 Favored 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.486 2.124 . . . . 0.0 112.246 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.548 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -145.48 -39.1 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.309 -179.753 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.732 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -102.83 -167.29 1.37 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.669 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.13 106.75 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.908 0.385 . . . . 0.0 111.883 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.555 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.6 p -103.21 111.74 34.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.12 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.641 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.27 144.85 50.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.528 -179.034 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.655 HG22 HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -103.9 128.56 57.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.181 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 62.4 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.772 179.938 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.7 tp . . . . . 0 N--CA 1.463 0.211 0 CA-C-O 120.695 0.284 . . . . 0.0 111.421 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -49.05 -49.49 41.1 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.801 0.334 . . . . 0.0 111.256 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -13.87 32.61 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HB3' ' CD1' ' A' ' 118' ' ' ILE . 2.5 m-85 -79.23 139.31 37.95 Favored 'General case' 0 C--O 1.231 0.127 0 O-C-N 122.196 -0.315 . . . . 0.0 110.604 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -127.93 -70.21 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.221 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.572 ' HA ' HD11 ' A' ' 97' ' ' LEU . 39.9 t -153.27 -44.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.004 0.431 . . . . 0.0 111.405 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -20.69 38.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.642 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -76.1 -45.01 36.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 -179.334 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.835 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -59.32 -59.61 5.18 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.396 0.617 . . . . 0.0 110.27 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.491 ' HE3' HD21 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -58.29 -30.74 66.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.02 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.66 -21.4 30.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.598 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.452 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 0.0 OUTLIER -85.0 -37.55 20.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.579 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.572 ' HG ' ' CZ ' ' A' ' 121' ' ' PHE . 5.0 mt -64.57 -45.49 86.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 109.573 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.401 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.6 OUTLIER -63.59 -40.34 96.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.857 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -77.31 -6.73 54.31 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.249 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -102.01 -15.22 16.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.024 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 77.91 61.42 2.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.376 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 106' ' ' ILE . 6.3 tt -151.66 93.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.785 0.326 . . . . 0.0 111.142 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.01 140.93 6.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.068 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.571 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -121.9 -86.41 0.65 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.779 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 51.84 103.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.802 0.334 . . . . 0.0 111.346 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 64.04 178.22 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.411 . . . . 0.0 111.009 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' SER . . . . . 0.533 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 2.4 m 56.46 23.01 7.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.037 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 111' ' ' SER . . . 168.14 75.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.04 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.75 -81.55 0.05 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.731 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.727 ' O ' HG22 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -131.88 -57.47 0.98 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.589 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.57 74.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 0.0 110.737 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -86.18 -33.54 20.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.359 0.599 . . . . 0.0 110.369 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.638 ' CD2' HD13 ' A' ' 97' ' ' LEU . 7.8 tp -78.09 -21.54 50.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.994 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.835 ' HA ' HD22 ' A' ' 97' ' ' LEU . 2.4 tp -82.77 -29.66 8.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.55 -31.02 21.46 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.71 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 tp -49.23 -45.1 44.1 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.07 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CZ ' ' HG ' ' A' ' 101' ' ' LEU . 48.8 m-85 . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.368 . . . . 0.0 110.953 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.895 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.675 0.274 . . . . 0.0 110.659 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.06 145.24 31.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.322 0.582 . . . . 0.0 112.535 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 14.5 p -92.75 126.52 37.87 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.95 153.59 11.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.459 -178.503 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.1 p -138.51 126.9 29.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 0.0 111.623 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.77 HG13 HD13 ' A' ' 45' ' ' LEU . 7.7 m -95.74 104.44 15.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.289 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -99.52 106.56 18.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 t30 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.815 -179.687 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.463 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 3.5 p-10 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.919 0.39 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.503 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 13.6 t-20 -122.24 133.83 54.7 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.054 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.6 m -87.1 145.42 26.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 111.63 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.914 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.84 142.18 44.53 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.998 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.914 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.4 157.58 37.53 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.33 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.23 113.05 6.22 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.688 0.756 . . . . 0.0 111.155 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.611 HG12 ' H ' ' A' ' 38' ' ' SER . 2.8 t -129.28 171.71 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.708 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.611 ' H ' HG12 ' A' ' 37' ' ' VAL . 42.7 m -56.38 -72.55 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.16 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.5 -16.67 0.11 Allowed 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 p -46.21 -41.09 12.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.72 -28.56 63.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 46' ' ' LYS . 10.6 tp -78.45 -50.59 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.0 110.8 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.53 -22.35 59.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.496 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -66.85 -44.56 80.71 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.934 0.397 . . . . 0.0 110.371 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.851 HD12 HG23 ' A' ' 53' ' ' VAL . 18.0 mt -78.88 -54.08 6.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.379 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 2.5 mttp -45.59 -28.75 1.02 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.469 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.82 -27.51 5.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.305 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.57 94.13 48.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.5 -21.27 18.08 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.733 2.289 . . . . 0.0 112.712 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.581 ' C ' HD13 ' A' ' 51' ' ' LEU . 9.1 ttm180 -47.65 -39.7 17.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.49 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.754 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -107.28 -165.22 1.04 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.519 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.59 140.75 48.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.747 0.308 . . . . 0.0 111.514 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.851 HG23 HD12 ' A' ' 45' ' ' LEU . 3.3 p -132.22 116.81 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.896 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.529 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.5 mt-30 -127.63 133.19 49.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.653 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.477 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -93.93 130.67 42.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.966 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.0 p . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.785 179.861 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 118' ' ' ILE . 4.2 mm? . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.826 0.346 . . . . 0.0 110.941 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -48.74 -35.87 15.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.698 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -62.23 -12.59 21.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.552 ' HB3' HD23 ' A' ' 97' ' ' LEU . 8.0 m-85 -80.73 -8.04 59.54 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.256 -0.278 . . . . 0.0 111.346 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.87 -162.17 0.19 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.779 0.323 . . . . 0.0 111.079 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.597 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.9 t -115.78 -42.72 3.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.21 0.529 . . . . 0.0 110.947 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -78.21 -19.71 53.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.121 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -27.53 54.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.0 110.675 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.757 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -76.35 -59.08 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.506 ' CE ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -47.38 -34.93 7.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.741 177.711 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.94 -21.71 29.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.021 0.439 . . . . 0.0 111.737 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.438 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 4.1 mm-40 -86.65 -38.59 16.91 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.566 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.611 HD23 ' CZ ' ' A' ' 121' ' ' PHE . 3.2 mt -59.84 -48.07 83.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.118 0.485 . . . . 0.0 109.964 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.568 HG23 ' CE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -65.44 -39.03 91.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -6.57 58.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.3 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.494 ' HD3' HD11 ' A' ' 106' ' ' ILE . 2.1 ttt85 -100.12 -15.57 18.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.308 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 98.72 38.9 3.77 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.339 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.494 HD11 ' HD3' ' A' ' 104' ' ' ARG . 4.2 mp -110.32 -22.01 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.793 0.296 . . . . 0.0 111.045 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 106' ' ' ILE . 14.7 t 45.51 28.34 0.49 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.794 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.568 ' CE1' HG23 ' A' ' 102' ' ' THR . 90.2 m-85 51.24 -160.23 0.09 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.108 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.8 pttt 45.52 93.13 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.064 0.459 . . . . 0.0 111.322 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 179.0 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.618 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 179.18 42.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.765 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.713 ' HB1' ' HB2' ' A' ' 117' ' ' LEU . . . -145.22 147.67 32.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.201 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.419 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 52.5 p -139.72 -80.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.4 tttm -145.38 -57.12 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.74 0.305 . . . . 0.0 110.74 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.0 -22.18 33.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.088 0.471 . . . . 0.0 109.884 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -86.2 -38.22 17.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 179.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.713 ' HB2' ' HB1' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -74.5 -36.82 63.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.181 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.849 ' O ' HD13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -62.67 -28.54 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.402 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.27 -33.0 19.41 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.918 0.39 . . . . 0.0 111.559 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.43 -53.02 62.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.611 ' CZ ' HD23 ' A' ' 101' ' ' LEU . 24.8 m-85 . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 120.939 0.399 . . . . 0.0 111.75 -178.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.757 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 8.0 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.834 0.35 . . . . 0.0 110.586 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -146.92 148.06 31.4 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.9 m -96.18 115.01 26.76 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.839 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -110.17 151.39 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-O 120.895 0.378 . . . . 0.0 111.59 -178.711 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.743 HG23 ' C ' ' A' ' 32' ' ' ASN . 7.6 p -137.4 131.7 44.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.538 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.849 HG13 HD13 ' A' ' 45' ' ' LEU . 29.3 m -93.06 104.75 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.287 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.402 ' HA ' ' HB3' ' A' ' 31' ' ' ASP . 0.6 OUTLIER -86.53 106.68 17.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.705 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.649 ' CG ' HD12 ' A' ' 51' ' ' LEU . 6.8 t30 . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.53 ' HB2' HG22 ' A' ' 11' ' ' VAL . 34.1 p-10 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.963 0.411 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.743 ' C ' HG23 ' A' ' 11' ' ' VAL . 2.0 t-20 -113.88 125.08 53.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.061 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.0 145.43 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.434 0.635 . . . . 0.0 111.685 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.939 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -112.09 138.95 48.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.816 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.939 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.45 156.68 39.04 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.279 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.757 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.46 108.4 4.26 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 111.426 -178.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.679 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -128.21 -176.51 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.186 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.679 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -48.82 -68.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.472 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.16 -17.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.5 t -42.42 -37.66 1.65 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.793 0.33 . . . . 0.0 111.687 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.686 ' HG2' HD11 ' A' ' 34' ' ' LEU . 2.3 pp0? -53.62 -50.46 65.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.456 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.683 HD13 ' CG2' ' A' ' 55' ' ' ILE . 5.7 tp -58.32 -46.47 86.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.091 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.87 -33.09 68.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.301 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -44.31 93.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.943 0.402 . . . . 0.0 110.279 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.849 HD13 HG13 ' A' ' 12' ' ' VAL . 21.9 mt -78.74 -33.63 46.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.885 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.4 mttt -71.17 -22.58 62.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.132 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.09 -61.83 1.7 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.574 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.03 124.51 53.94 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.69 56.89 6.24 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.576 2.184 . . . . 0.0 112.418 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.563 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -111.69 -39.36 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.944 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.688 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -111.86 -173.1 2.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.446 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 52' ' ' VAL . 16.2 m -119.44 106.26 18.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.835 0.35 . . . . 0.0 111.881 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.469 HG23 HD12 ' A' ' 45' ' ' LEU . 2.5 p -99.87 106.19 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.172 0.51 . . . . 0.0 110.757 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.455 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -127.33 127.89 45.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.107 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.839 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.13 130.35 37.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.05 0.452 . . . . 0.0 111.455 -179.824 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.9 p . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.559 179.656 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.5 HD11 ' O ' ' A' ' 118' ' ' ILE . 1.7 mm? . . . . . 0 CA--C 1.529 0.145 0 CA-C-O 120.54 0.21 . . . . 0.0 111.386 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -48.62 -49.44 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.7 0.286 . . . . 0.0 111.221 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -10.1 10.3 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 3.7 m-85 -104.9 127.45 52.73 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.691 0.281 . . . . 0.0 110.655 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.499 ' O ' HG21 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -116.3 -87.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.06 -179.729 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.789 ' HA ' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -151.83 -37.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-O 120.972 0.415 . . . . 0.0 111.047 179.855 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.63 -19.66 35.05 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.869 0.366 . . . . 0.0 110.99 178.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -77.91 -43.1 31.03 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.246 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.966 HD23 HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -64.8 -55.84 17.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.868 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.465 ' CD ' ' O ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -50.89 -31.95 19.08 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.0 178.785 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.06 -25.26 27.71 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.122 0.487 . . . . 0.0 111.537 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 1.7 mt-30 -86.88 -43.59 12.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.888 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.776 HD22 HG21 ' A' ' 106' ' ' ILE . 8.8 mt -54.74 -46.75 74.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.465 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -39.07 88.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.855 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -15.85 63.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.652 ' HD3' HD23 ' A' ' 101' ' ' LEU . 8.7 ptm180 -107.96 -15.23 14.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.047 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.59 83.9 0.47 Allowed Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.826 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.776 HG21 HD22 ' A' ' 101' ' ' LEU . 14.6 tt -125.84 -39.46 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.69 0.281 . . . . 0.0 111.524 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.1 m 71.58 87.8 0.11 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.647 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -116.0 124.89 51.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.997 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -176.98 37.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -170.8 30.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.341 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 84.2 p 178.78 -76.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.749 0.309 . . . . 0.0 110.922 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 117' ' ' LEU . . . -64.08 81.02 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.734 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -72.4 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.364 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.776 ' O ' HG23 ' A' ' 118' ' ' ILE . 0.3 OUTLIER -146.05 -57.44 0.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.491 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.28 67.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 11.8 mm-40 -85.91 -37.1 19.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.886 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.966 HD21 HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -69.15 -40.85 77.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.828 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.776 HG23 ' O ' ' A' ' 114' ' ' LYS . 0.9 OUTLIER -70.6 -30.5 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.476 ' N ' HG13 ' A' ' 118' ' ' ILE . . . -86.16 -31.83 21.6 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.34 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 1.1 mp -54.52 -42.75 71.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.323 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.511 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 1.9 m-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.601 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.776 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 12.5 t . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.962 0.41 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -146.79 145.28 29.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.24 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.6 p -94.45 133.4 38.08 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.762 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.43 155.86 11.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 121.039 0.447 . . . . 0.0 111.569 -179.093 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.3 p -138.34 101.53 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.596 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.719 HG21 HD22 ' A' ' 45' ' ' LEU . 36.2 t -92.69 129.23 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.161 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.81 107.41 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 120.909 0.385 . . . . 0.0 110.753 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 121.047 0.451 . . . . 0.0 111.411 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 23.0 t-20 -143.64 123.66 13.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.4 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -86.85 145.58 26.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.398 0.618 . . . . 0.0 111.361 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.939 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -115.37 141.37 48.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.97 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.939 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.32 156.1 39.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.158 0.504 . . . . 0.0 110.555 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.776 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.56 105.34 3.07 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.496 0.665 . . . . 0.0 111.715 -177.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.647 HG23 ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -122.31 -175.92 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.909 -179.674 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.647 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -59.73 -63.91 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.558 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -173.43 -18.64 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.7 m -42.41 -32.1 0.49 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.991 0.424 . . . . 0.0 111.011 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.649 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.59 -61.64 2.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.548 179.268 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.467 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 7.3 tp -52.6 -52.83 53.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.71 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.591 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -66.42 -34.88 78.95 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.682 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.09 -52.52 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.909 0.385 . . . . 0.0 110.438 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.719 HD22 HG21 ' A' ' 12' ' ' VAL . 0.5 OUTLIER -78.71 -54.54 6.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.748 179.516 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.532 ' N ' HG11 ' A' ' 53' ' ' VAL . 1.3 tptt -53.47 -24.05 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.304 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.26 -29.94 1.82 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 111.372 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -128.62 125.78 23.2 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 61.28 4.96 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.405 2.07 . . . . 0.0 112.366 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.805 ' C ' HD13 ' A' ' 51' ' ' LEU . 20.8 mmt-85 -123.91 -39.69 2.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.805 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.0 OUTLIER -119.85 133.44 55.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.962 0.41 . . . . 0.0 110.971 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 12' ' ' VAL . 4.2 t -68.87 107.21 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.768 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.532 HG11 ' N ' ' A' ' 46' ' ' LYS . 2.1 p -103.4 115.26 45.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.938 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.754 ' O ' HG22 ' A' ' 10' ' ' VAL . 31.0 mt-30 -127.07 144.9 50.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.833 -0.622 . . . . 0.0 112.165 -178.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.748 HG22 HG23 ' A' ' 10' ' ' VAL . 1.9 pt -102.64 134.39 43.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.176 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.8 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.962 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.561 ' N ' HD22 ' A' ' 89' ' ' LEU . 3.0 mm? . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.866 0.365 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -48.97 -37.18 19.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.495 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 38.3 p -61.98 -15.21 42.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -94.23 133.8 37.37 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.804 0.335 . . . . 0.0 110.675 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.671 ' O ' HG13 ' A' ' 94' ' ' VAL . 3.0 p -74.45 -94.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.359 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.671 HG13 ' O ' ' A' ' 93' ' ' THR . 1.4 m -164.41 -38.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.054 0.454 . . . . 0.0 110.79 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.75 -20.88 38.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.691 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -66.95 -52.23 45.45 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.349 0.595 . . . . 0.0 109.74 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 1.044 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.92 -59.61 4.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.715 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.45 ' HE3' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -44.65 -38.35 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.939 178.431 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.19 -21.92 28.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.048 0.452 . . . . 0.0 111.669 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 6.8 mm-40 -86.37 -47.81 9.02 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.09 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.667 HD13 HG21 ' A' ' 106' ' ' ILE . 5.5 mt -51.89 -48.3 64.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.164 0.506 . . . . 0.0 109.845 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.497 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -62.12 -41.42 98.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.229 179.462 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.74 -6.96 50.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.106 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -105.81 -15.43 14.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 78.5 70.94 1.27 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.94 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.718 HG23 ' N ' ' A' ' 107' ' ' THR . 0.2 OUTLIER -128.26 -159.33 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.718 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -140.45 116.11 10.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.838 0.351 . . . . 0.0 110.791 179.88 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.497 ' CZ ' HG23 ' A' ' 102' ' ' THR . 2.4 p90 -138.72 105.85 5.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.987 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -176.78 37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.783 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.52 -50.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 91.6 p -101.05 -63.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.465 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -70.61 64.79 0.3 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.07 0.462 . . . . 0.0 110.334 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -61.19 -75.14 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.346 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.976 ' O ' HG23 ' A' ' 118' ' ' ILE . 1.5 ptmt -146.3 -57.46 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.718 0.294 . . . . 0.0 111.434 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.24 -23.01 64.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.863 0.363 . . . . 0.0 111.115 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.4 mm-40 -85.82 -36.29 20.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.855 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.765 ' HG ' HD13 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -74.48 -37.11 63.28 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.597 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 1.044 ' HA ' HD22 ' A' ' 97' ' ' LEU . 1.7 pp -64.72 -35.19 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.579 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.33 -28.26 23.79 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.891 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.789 ' O ' HD22 ' A' ' 120' ' ' LEU . 1.0 OUTLIER -65.01 -30.6 71.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.687 -179.086 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.507 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 120.721 0.296 . . . . 0.0 111.151 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.844 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.637 0.256 . . . . 0.0 110.793 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.612 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -145.22 144.09 30.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.43 0.633 . . . . 0.0 112.393 -179.522 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.4 p -95.1 121.83 37.14 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.801 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 151.53 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 111.355 -178.775 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.9 p -134.17 123.5 43.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.242 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.119 HG13 HD23 ' A' ' 45' ' ' LEU . 1.8 m -95.65 104.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.784 -179.316 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.43 106.89 19.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.896 178.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 . . . . . 0 C--N 1.329 -0.297 0 CA-C-O 121.24 0.543 . . . . 0.0 111.61 -179.2 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.484 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 2.2 p30 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.679 0.276 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.2 t30 -116.74 131.94 56.82 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.291 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.02 145.54 26.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.536 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.961 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -113.75 140.61 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.19 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.961 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.29 157.5 37.59 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.202 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.844 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.4 112.74 6.14 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.734 0.778 . . . . 0.0 111.2 -177.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.547 ' N ' HG22 ' A' ' 7' ' ' THR . 3.5 t -128.35 168.82 20.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 CA-C-N 114.463 -1.244 . . . . 0.0 110.584 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.54 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.2 m -55.3 -61.25 2.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.273 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -164.91 -16.76 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.488 ' OG ' HG11 ' A' ' 37' ' ' VAL . 3.0 p -43.62 -33.67 1.25 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.612 ' NE2' ' CE1' ' A' ' 8' ' ' PHE . 4.4 pp0? -65.79 -37.43 86.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.799 0.333 . . . . 0.0 111.749 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.529 ' HB2' ' NE2' ' A' ' 41' ' ' GLN . 5.2 tp -68.31 -38.75 81.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -86.86 -28.99 22.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.276 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -47.93 81.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.874 0.369 . . . . 0.0 110.378 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 1.119 HD23 HG13 ' A' ' 12' ' ' VAL . 1.9 mp -79.02 -41.53 28.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.46 ' N ' HG11 ' A' ' 53' ' ' VAL . 3.5 ttpt -73.27 -12.74 60.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.299 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.565 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -50.81 -33.29 22.92 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.822 0.344 . . . . 0.0 111.295 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 p-10 -121.66 129.83 25.03 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.83 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -77.09 70.82 6.52 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.5 2.134 . . . . 0.0 112.272 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.431 ' C ' HD12 ' A' ' 51' ' ' LEU . 2.0 mtt85 -131.8 -56.01 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.886 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 51' ' ' LEU . 2.8 mp -100.51 170.46 8.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.628 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.9 t -105.58 107.39 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.608 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.509 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 1.5 p -101.18 114.57 40.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.29 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.476 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.8 OUTLIER -127.12 125.93 42.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.454 -179.232 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.801 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.19 145.79 7.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.289 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 44.3 p . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.644 179.694 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 118' ' ' ILE . 12.5 tp . . . . . 0 N--CA 1.462 0.143 0 CA-C-O 120.644 0.259 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.8 m-20 -48.78 -45.63 40.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.428 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.3 p -62.09 -14.55 37.63 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -84.09 143.82 29.46 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.684 0.278 . . . . 0.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 69.9 p -110.63 -88.23 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.588 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.617 HG13 ' HG3' ' A' ' 114' ' ' LYS . 40.6 t -154.56 -43.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -80.3 -20.84 43.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.081 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.1 -49.58 42.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 0.0 110.19 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.776 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -56.02 -58.56 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.528 179.557 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.476 ' HE2' HD11 ' A' ' 117' ' ' LEU . 4.1 ttmt -55.63 -34.67 65.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.02 -21.64 29.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.056 0.455 . . . . 0.0 111.573 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.466 ' N ' ' O ' ' A' ' 96' ' ' GLN . 3.5 mm-40 -86.53 -41.09 14.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.302 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.69 HD22 HG21 ' A' ' 106' ' ' ILE . 12.9 mt -56.14 -49.91 72.61 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.315 0.579 . . . . 0.0 109.754 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.69 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -64.11 -38.96 92.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.324 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.65 -6.84 53.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.957 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.3 mtt180 -100.36 -15.32 18.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.858 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.96 47.58 4.97 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.838 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.69 HG21 HD22 ' A' ' 101' ' ' LEU . 9.2 tt -140.43 95.91 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.822 0.344 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.03 122.94 9.33 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.951 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.69 ' HE1' HG23 ' A' ' 102' ' ' THR . 13.7 p90 -121.56 28.02 7.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.131 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -29.34 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.852 0.358 . . . . 0.0 110.77 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -124.98 150.97 46.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.855 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.15 26.34 13.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 108' ' ' PHE . . . -148.53 103.99 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.18 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.4 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 72.3 p -98.92 -79.38 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.725 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.668 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 20.4 tttt -158.4 -39.5 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.087 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.7 -20.44 33.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.028 0.442 . . . . 0.0 110.224 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -85.59 -39.08 17.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.756 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.668 ' CD2' ' HA ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -78.31 -19.55 53.31 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.153 -179.771 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.776 ' HA ' HD22 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -80.79 -28.39 11.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 120.566 -0.453 . . . . 0.0 109.974 178.156 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.428 ' HA ' HD11 ' A' ' 89' ' ' LEU . . . -87.09 -33.12 19.59 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.133 0.492 . . . . 0.0 111.106 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.18 -42.76 70.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.269 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.578 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 30.7 m-85 . . . . . 0 C--N 1.329 -0.314 0 CA-C-O 120.917 0.389 . . . . 0.0 111.305 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.867 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.686 0.279 . . . . 0.0 110.821 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.502 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -145.17 143.81 30.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.434 0.635 . . . . 0.0 112.632 -179.659 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 24.4 p -95.55 121.4 37.2 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.772 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.73 150.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.003 0.43 . . . . 0.0 111.282 -178.869 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.4 p -134.06 120.58 35.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.259 0.552 . . . . 0.0 111.522 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.723 HG11 HD22 ' A' ' 45' ' ' LEU . 11.5 m -94.17 104.53 15.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.382 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -98.63 105.28 17.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.419 . . . . 0.0 110.15 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.642 HD21 HG13 ' A' ' 52' ' ' VAL . 13.1 m120 . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.065 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.404 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.758 0.314 . . . . 0.0 110.735 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 17.9 t30 -129.94 131.04 45.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.943 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.14 145.48 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.302 0.572 . . . . 0.0 111.121 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.966 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.72 140.46 46.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.26 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.966 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.26 157.63 37.35 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.11 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.867 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.6 112.13 5.88 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.685 0.755 . . . . 0.0 111.287 -177.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.553 ' N ' HG22 ' A' ' 7' ' ' THR . 4.1 t -127.77 168.26 21.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.088 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.656 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.524 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.7 t -55.09 -58.85 5.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.397 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -167.91 -17.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.5 m -43.43 -33.25 1.03 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.737 HE22 ' CG2' ' A' ' 55' ' ' ILE . 4.2 pp0? -66.52 -41.45 88.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.829 0.347 . . . . 0.0 111.837 -179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.478 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 4.8 tp -66.77 -34.36 77.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.501 -178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -91.94 -30.71 15.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.632 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.31 -42.42 88.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.947 0.403 . . . . 0.0 110.41 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.723 HD22 HG11 ' A' ' 12' ' ' VAL . 63.0 mt -79.04 -47.22 16.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.925 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.414 ' N ' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -60.44 -17.82 47.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.438 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.13 -39.87 6.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.801 0.334 . . . . 0.0 111.65 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.1 121.56 58.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -84.17 49.42 2.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.677 2.252 . . . . 0.0 112.774 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.23 -38.1 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.272 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.739 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -93.55 -165.59 1.36 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.426 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.672 ' O ' HG12 ' A' ' 12' ' ' VAL . 2.3 m -132.56 133.0 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.414 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.6 p -131.83 112.83 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.021 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.514 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.4 OUTLIER -127.66 126.21 41.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.837 -178.998 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.772 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.4 pp -88.11 126.66 41.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.042 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.1 p . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 179.88 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 89' ' ' LEU . 3.1 mm? . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.586 0.231 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -49.07 -50.12 38.27 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.726 0.298 . . . . 0.0 111.132 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -13.05 25.9 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -94.84 122.82 37.86 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.643 0.259 . . . . 0.0 110.6 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.555 ' O ' HD11 ' A' ' 97' ' ' LEU . 15.9 p -117.98 -95.49 0.48 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.349 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.954 ' HA ' HD21 ' A' ' 97' ' ' LEU . 3.4 m -138.2 -34.87 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.89 0.376 . . . . 0.0 111.438 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -82.78 -20.41 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.283 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -38.22 21.98 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.954 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -76.3 -49.21 17.56 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.024 -0.671 . . . . 0.0 109.717 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.691 ' HE2' HD11 ' A' ' 117' ' ' LEU . 0.9 OUTLIER -56.44 -33.75 66.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.696 178.578 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.18 -25.76 27.21 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 111.973 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 3.5 mt-30 -86.68 -42.82 13.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.014 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.924 HD22 HG21 ' A' ' 106' ' ' ILE . 6.6 mt -54.48 -48.1 72.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.087 0.47 . . . . 0.0 110.385 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -39.64 92.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.062 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -6.85 52.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -106.17 -15.22 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.047 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.89 68.4 1.56 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.774 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.924 HG21 HD22 ' A' ' 101' ' ' LEU . 0.4 OUTLIER -119.28 -146.74 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.641 ' N ' HG23 ' A' ' 106' ' ' ILE . 4.8 t -150.78 105.11 3.24 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 122.169 -0.332 . . . . 0.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.656 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.8 p90 -142.92 66.28 1.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.948 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.35 -31.14 7.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.48 62.11 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.045 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 179.35 -38.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.024 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.656 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -112.49 108.31 17.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.017 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.75 -74.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.308 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.792 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -144.83 -43.89 0.24 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -78.78 -24.31 44.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.929 0.395 . . . . 0.0 110.569 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.6 mm-40 -85.94 -36.5 19.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.563 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.834 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -80.04 -19.71 46.97 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.204 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.834 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -27.01 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.654 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.99 -34.55 19.22 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.764 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.5 tp -51.57 -44.4 62.73 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.472 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.471 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 4.9 m-85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.749 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 5.6 t . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.82 0.343 . . . . 0.0 110.761 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.08 152.25 38.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.098 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 2.6 m -92.4 124.96 36.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -110.12 151.18 12.41 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 111.659 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -138.01 132.9 43.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.368 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.646 HG12 ' O ' ' A' ' 52' ' ' VAL . 28.0 m -101.97 104.71 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.795 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.438 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -101.34 106.59 17.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.006 179.01 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.253 0.549 . . . . 0.0 111.671 -179.265 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.438 ' HB3' ' CG ' ' A' ' 13' ' ' GLN . 3.5 p-10 . . . . . 0 N--CA 1.456 -0.129 0 CA-C-O 121.038 0.447 . . . . 0.0 111.265 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.427 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 16.2 m-20 -126.71 127.53 45.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.956 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.7 m -86.96 145.32 26.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.422 0.63 . . . . 0.0 111.739 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.957 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -111.51 138.22 48.32 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.698 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.957 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.48 156.41 39.41 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.923 0.392 . . . . 0.0 110.192 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.749 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.72 109.96 5.24 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.431 0.634 . . . . 0.0 111.723 -177.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.649 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -128.78 -177.01 1.74 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.039 -179.654 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.649 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -51.13 -64.85 0.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.366 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -177.75 -16.59 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.25 -34.47 0.78 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.586 ' HG2' HD11 ' A' ' 34' ' ' LEU . 1.4 pp0? -57.25 -49.87 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 0.0 111.232 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -56.14 -53.66 54.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.088 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.19 -27.0 64.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.216 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -64.5 -51.85 60.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.86 0.362 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.536 ' HG ' ' CG1' ' A' ' 12' ' ' VAL . 3.2 mm? -78.51 -32.18 47.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.088 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.653 ' HB2' HG11 ' A' ' 53' ' ' VAL . 13.8 tttt -75.11 -29.6 60.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.156 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -56.12 -62.84 1.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.6 120.43 81.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.83 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.41 59.91 6.85 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.514 2.142 . . . . 0.0 112.41 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.521 ' C ' HD13 ' A' ' 51' ' ' LEU . 1.9 mpt_? -115.91 -64.54 1.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.982 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.632 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -106.99 -176.82 3.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.566 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 12' ' ' VAL . 3.1 m -103.55 146.37 11.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.774 0.321 . . . . 0.0 111.782 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.653 HG11 ' HB2' ' A' ' 46' ' ' LYS . 4.8 p -126.66 116.72 45.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.805 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.743 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -127.41 139.54 52.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.336 -179.482 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.429 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -95.11 117.66 39.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.36 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.5 p . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.68 179.817 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.491 ' N ' HD22 ' A' ' 89' ' ' LEU . 3.1 mm? . . . . . 0 C--O 1.23 0.027 0 CA-C-O 120.853 0.359 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -48.93 -43.65 39.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.633 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.0 m -61.99 -14.19 32.88 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.533 ' CD1' ' CE2' ' A' ' 121' ' ' PHE . 24.0 m-85 -114.13 104.8 12.48 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.819 0.343 . . . . 0.0 110.644 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.409 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.2 OUTLIER -84.48 -86.58 0.12 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.164 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.798 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 11.3 t -148.25 -56.61 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.775 0.321 . . . . 0.0 111.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.44 -20.18 61.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.963 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -20.88 42.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.124 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.69 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -78.4 -58.56 3.19 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.401 -179.619 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.798 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.3 ptpt -62.14 -25.68 67.88 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.274 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.76 -29.55 25.38 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.021 0.438 . . . . 0.0 112.164 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 29.0 mt-30 -86.72 -29.4 22.43 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.738 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.852 HD22 ' HB ' ' A' ' 106' ' ' ILE . 6.0 mt -67.05 -46.29 74.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.22 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.729 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.988 179.553 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.97 -6.81 49.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.087 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.3 mtt-85 -106.44 -15.3 14.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.957 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.93 64.45 1.42 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.841 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.852 ' HB ' HD22 ' A' ' 101' ' ' LEU . 18.1 mt -151.16 100.49 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.66 0.267 . . . . 0.0 111.167 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -57.18 122.25 12.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.84 0.352 . . . . 0.0 110.921 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.729 ' HE1' HG23 ' A' ' 102' ' ' THR . 13.8 p90 -130.56 5.54 4.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.547 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -99.14 31.48 3.03 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 0.0 110.91 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.38 25.97 0.6 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.5 p 177.19 -37.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.914 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.466 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -82.99 175.89 9.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.3 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.552 ' O ' HD13 ' A' ' 117' ' ' LEU . 25.0 p -150.55 -80.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.748 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.5 pttt -145.35 -46.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.458 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.59 -25.2 41.6 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 0.0 110.264 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.14 -36.73 19.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.401 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.925 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -79.7 -19.42 48.96 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.054 -179.505 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.925 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.74 -30.18 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 120.874 0.369 . . . . 0.0 110.268 178.502 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.83 -32.38 19.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.286 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.837 HD11 HD21 ' A' ' 101' ' ' LEU . 1.5 pp -72.5 -17.11 61.77 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.633 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.75 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 9.5 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.843 0.354 . . . . 0.0 110.647 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.07 146.03 29.85 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.4 m -94.63 115.86 28.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.879 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -110.27 151.74 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.131 0.491 . . . . 0.0 112.061 -178.312 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.562 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.3 p -138.08 128.2 35.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.151 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.062 HG13 HD13 ' A' ' 45' ' ' LEU . 23.4 m -96.78 104.81 16.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.921 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -92.94 106.53 18.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.024 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.916 ' CB ' HD22 ' A' ' 51' ' ' LEU . 21.8 p-10 . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 121.089 0.471 . . . . 0.0 112.185 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.422 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 121.005 0.431 . . . . 0.0 111.114 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.0 t30 -107.1 122.0 45.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.871 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.1 p -86.7 145.45 26.68 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.538 0.685 . . . . 0.0 111.544 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.934 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -117.2 139.12 51.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.25 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.934 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.85 156.93 38.96 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 120.825 0.345 . . . . 0.0 110.102 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.75 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.23 107.07 3.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.474 0.654 . . . . 0.0 111.544 -177.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.695 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -124.66 -175.91 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.296 -179.401 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.695 ' N ' HG23 ' A' ' 37' ' ' VAL . 16.4 m -51.68 -68.02 0.2 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.528 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -176.1 -21.43 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.4 -35.23 0.97 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.882 0.372 . . . . 0.0 111.478 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.733 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.22 -39.03 69.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.52 179.81 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.496 HD13 ' CG2' ' A' ' 55' ' ' ILE . 6.1 tp -70.58 -39.67 73.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.775 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.47 -27.37 56.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.53 -45.02 66.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.009 0.433 . . . . 0.0 110.491 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 1.062 HD13 HG13 ' A' ' 12' ' ' VAL . 51.4 mt -78.7 -30.6 46.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.014 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -69.84 -19.65 63.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.224 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.14 -55.01 27.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.38 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.41 118.65 64.38 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.999 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -81.85 54.7 5.17 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.632 2.221 . . . . 0.0 112.394 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -149.14 -63.28 0.23 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.719 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.916 HD22 ' CB ' ' A' ' 14' ' ' ASN . 18.1 mt -63.66 175.93 0.99 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.489 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' VAL . 3.4 m -120.55 123.06 69.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.493 HG22 HD12 ' A' ' 42' ' ' LEU . 2.0 p -116.9 106.28 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 0.0 110.299 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.517 ' O ' HG22 ' A' ' 10' ' ' VAL . 5.0 mt-30 -127.48 131.21 50.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.021 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.879 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.07 119.24 35.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.264 0.554 . . . . 0.0 111.622 -179.538 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 p . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.466 179.779 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.464 0.272 0 CA-C-O 120.695 0.283 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -48.86 -47.34 42.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.475 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.9 p -62.14 -12.78 21.52 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -115.46 122.43 45.73 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.674 0.273 . . . . 0.0 110.435 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.438 ' N ' HD11 ' A' ' 97' ' ' LEU . 93.5 m -84.75 -98.69 0.06 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.48 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.778 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 43.3 t -142.31 -56.84 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.075 0 CA-C-O 120.816 0.341 . . . . 0.0 111.361 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.25 -20.13 61.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.819 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.52 -21.18 38.76 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.083 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.768 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -75.35 -58.74 3.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.357 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.86 ' O ' HG23 ' A' ' 102' ' ' THR . 1.8 ptpt -57.82 -26.9 62.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.95 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.09 29.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.044 0.45 . . . . 0.0 111.663 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -86.79 -38.28 17.02 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 101' ' ' LEU . 22.8 mt -63.83 -42.64 97.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.662 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.86 HG23 ' O ' ' A' ' 98' ' ' LYS . 12.7 p -65.73 -40.82 92.56 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.113 0.482 . . . . 0.0 109.907 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -6.91 50.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.348 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 36.6 mtt180 -106.03 -15.27 14.94 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.158 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.35 42.25 5.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.598 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 23.4 mm -128.41 92.27 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.714 0.293 . . . . 0.0 111.201 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 p -57.75 151.13 18.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.847 0.356 . . . . 0.0 110.864 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.66 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.3 p90 -153.5 36.66 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.017 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -45.41 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -134.72 24.47 3.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.005 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 -33.58 4.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.993 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.66 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -139.67 119.64 13.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.142 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.499 ' O ' HD13 ' A' ' 117' ' ' LEU . 68.6 p -92.21 -73.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.693 ' O ' HG22 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -145.25 -40.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -24.05 32.77 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.5 mm-40 -86.08 -38.46 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.434 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.922 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -76.25 -19.91 57.9 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.587 -0.278 . . . . 0.0 111.213 -179.318 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.922 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.6 -33.17 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.249 -0.58 . . . . 0.0 109.582 177.927 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.43 -28.28 22.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 18.5 tp -48.77 -43.79 38.17 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.252 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.55 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 9.2 m-85 . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.535 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.92 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.514 0.197 . . . . 0.0 110.695 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.518 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.81 145.68 31.76 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.8 p -94.12 133.15 37.92 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.738 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -109.98 148.3 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.522 0.677 . . . . 0.0 111.85 -178.935 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.9 p -138.15 101.18 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.958 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.068 HG21 HD22 ' A' ' 45' ' ' LEU . 78.9 t -92.6 136.71 24.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.196 -178.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -119.3 112.45 19.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.572 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.05 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.858 0.361 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.4 p-10 -124.75 133.12 53.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.21 145.61 26.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.069 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.943 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -113.33 143.07 45.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.191 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.943 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.62 156.72 39.09 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-O 121.091 0.472 . . . . 0.0 110.402 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.92 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.24 115.64 9.67 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.415 0.626 . . . . 0.0 111.551 -177.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.626 HG23 ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -129.72 -173.24 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.958 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.626 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -65.35 -59.19 4.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.552 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -171.2 -16.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.1 m -42.23 -40.82 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.616 ' NE2' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.37 -43.04 83.2 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.216 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.557 HD13 HG23 ' A' ' 55' ' ' ILE . 19.7 tp -64.52 -55.36 21.11 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.194 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.736 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.99 -23.14 62.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.537 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.25 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.861 0.362 . . . . 0.0 110.276 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 1.068 HD22 HG21 ' A' ' 12' ' ' VAL . 0.8 OUTLIER -78.93 -57.47 3.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.931 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.487 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -51.85 -23.27 4.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.609 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.736 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -43.37 -31.43 0.67 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.781 0.324 . . . . 0.0 111.498 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.04 128.01 24.59 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.683 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.95 77.42 2.73 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.426 2.084 . . . . 0.0 112.22 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.61 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -146.54 -45.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.184 -179.846 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.61 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -110.61 124.8 52.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.974 0.416 . . . . 0.0 110.827 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.413 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.0 t -64.7 106.06 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.625 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.828 ' HA ' HG22 ' A' ' 12' ' ' VAL . 2.9 p -99.03 123.97 51.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.147 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.738 ' O ' HG22 ' A' ' 10' ' ' VAL . 19.8 pt20 -127.0 141.09 51.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.081 -178.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.557 HG23 HD13 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -100.58 112.7 34.15 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.039 179.539 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 56' ' ' THR . 3.3 t . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.424 ' HA ' HD13 ' A' ' 89' ' ' LEU . 2.3 mm? . . . . . 0 N--CA 1.466 0.348 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -48.44 -45.02 35.91 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.565 0.221 . . . . 0.0 111.288 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 p -62.11 -13.21 24.48 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.404 ' HB3' HD12 ' A' ' 97' ' ' LEU . 5.7 m-85 -90.07 115.61 27.47 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.681 0.277 . . . . 0.0 110.427 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.785 HG22 HG22 ' A' ' 94' ' ' VAL . 90.4 m -91.22 -107.46 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.778 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.822 ' HA ' HD21 ' A' ' 97' ' ' LEU . 10.0 m -135.61 -32.02 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.25 0 CA-C-O 120.916 0.389 . . . . 0.0 111.494 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -83.58 -20.0 34.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.736 0.303 . . . . 0.0 111.068 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.6 OUTLIER -81.53 -32.61 32.21 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.571 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.832 HD13 ' H ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -77.87 -50.03 13.07 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -179.788 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.568 ' H ' HD22 ' A' ' 97' ' ' LEU . 3.3 ptpt -62.24 -28.11 69.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.86 -30.39 24.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.963 0.411 . . . . 0.0 111.98 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -86.82 -27.9 23.24 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.675 HD22 HG21 ' A' ' 106' ' ' ILE . 6.5 mt -64.73 -47.23 79.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.261 0.553 . . . . 0.0 109.742 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -34.83 74.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.749 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.28 -12.57 61.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.314 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.57 ' HD3' HD23 ' A' ' 101' ' ' LEU . 9.6 ptm180 -110.89 -15.26 13.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.052 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.05 82.72 0.79 Allowed Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.791 -0.718 . . . . 0.0 113.16 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.675 HG21 HD22 ' A' ' 101' ' ' LEU . 8.4 tp -126.74 -40.83 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.698 0.285 . . . . 0.0 111.376 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.431 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.2 OUTLIER 73.65 90.83 0.09 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.846 0.355 . . . . 0.0 110.624 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.91 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 14.1 p90 -115.26 139.03 50.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.114 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -43.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.788 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -128.22 27.41 5.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.67 30.27 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.97 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.91 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -178.46 59.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.015 0.436 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.607 ' O ' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -59.79 -83.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.7 ' HA ' HD22 ' A' ' 117' ' ' LEU . 4.3 ptpt -139.62 -43.79 0.44 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.812 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.86 -24.5 41.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.998 0.428 . . . . 0.0 110.253 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -86.19 -36.55 19.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.837 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.93 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.97 -21.57 50.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.375 -179.145 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.93 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.12 -27.54 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.148 177.677 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.21 -34.17 19.09 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.143 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -49.33 -46.26 46.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.871 -179.003 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.613 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 53.0 m-85 . . . . . 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.399 . . . . 0.0 111.348 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.787 HG22 ' C ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.756 0.312 . . . . 0.0 110.598 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.472 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.15 146.46 31.79 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.523 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.3 p -96.9 119.81 36.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.755 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.76 151.55 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.176 0.513 . . . . 0.0 111.633 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.564 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -134.94 126.27 46.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.086 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.065 HG13 HD13 ' A' ' 45' ' ' LEU . 9.0 m -95.86 104.77 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.341 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -88.82 106.56 18.46 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-O 121.447 0.641 . . . . 0.0 111.946 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.559 ' HB2' HG22 ' A' ' 11' ' ' VAL . 36.4 p-10 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.908 0.385 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.8 t-20 -122.01 136.46 54.92 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.083 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.02 145.2 26.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.492 0.663 . . . . 0.0 111.715 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.938 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -111.97 141.44 45.63 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.885 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.938 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.39 157.58 37.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.393 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.787 ' C ' HG22 ' A' ' 7' ' ' THR . . . -69.5 112.02 5.73 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.622 0.725 . . . . 0.0 111.243 -177.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.543 ' N ' HG22 ' A' ' 7' ' ' THR . 5.3 t -127.84 168.62 20.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.64 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.525 ' H ' HG12 ' A' ' 37' ' ' VAL . 19.4 t -54.36 -62.07 1.9 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.525 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -164.92 -16.61 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.42 -45.27 4.31 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.687 HE22 ' CG2' ' A' ' 55' ' ' ILE . 2.5 pp0? -53.4 -47.04 69.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.801 0.334 . . . . 0.0 111.693 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.437 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 8.7 tp -57.89 -46.56 84.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.518 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.18 -28.44 48.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.661 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -50.69 67.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.938 0.399 . . . . 0.0 110.712 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 1.065 HD13 HG13 ' A' ' 12' ' ' VAL . 32.4 mt -79.0 -34.3 44.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.414 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.57 ' N ' HG11 ' A' ' 53' ' ' VAL . 1.7 ttmt -77.7 -10.27 59.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.322 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.47 -45.54 73.19 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.717 0.294 . . . . 0.0 111.261 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -93.28 127.95 44.7 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -79.31 85.79 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.518 2.145 . . . . 0.0 112.565 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -167.13 -72.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.855 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.47 171.03 3.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.609 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.5 t -115.35 106.75 21.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.927 0.394 . . . . 0.0 111.908 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.57 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.3 p -104.02 111.19 32.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.05 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.508 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.3 mm-40 -127.17 133.54 50.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.523 -179.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.755 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.31 133.37 30.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.119 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.3 p . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.792 -179.927 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 89' ' ' LEU . 8.7 tp . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.594 0.235 . . . . 0.0 111.294 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -49.17 -50.25 38.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.655 0.265 . . . . 0.0 111.125 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.22 -10.18 14.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.439 ' CD1' ' HA ' ' A' ' 89' ' ' LEU . 4.4 m-85 -88.29 120.92 30.11 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.6 0.238 . . . . 0.0 110.528 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.6 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -133.8 -91.48 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.876 ' HA ' HD21 ' A' ' 97' ' ' LEU . 20.4 t -131.39 -44.58 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 121.027 0.441 . . . . 0.0 111.65 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.428 ' O ' ' HB3' ' A' ' 99' ' ' ALA . 5.7 pt-20 -82.29 -19.99 38.39 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -85.72 -29.29 24.04 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.876 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -84.59 -55.24 4.23 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.453 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.802 ' HE2' HD11 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -55.13 -32.83 62.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.794 178.765 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 95' ' ' GLU . . . -85.36 -24.85 27.42 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.989 0.423 . . . . 0.0 112.086 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 71.5 mt-30 -86.57 -45.29 11.2 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.923 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.531 HD22 ' HB ' ' A' ' 106' ' ' ILE . 4.7 mt -50.89 -49.05 60.16 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.994 0.426 . . . . 0.0 110.38 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.589 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -66.66 -38.27 86.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.113 179.599 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -77.17 -6.69 53.92 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.333 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -104.07 -15.18 15.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.215 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.57 ' O ' HD13 ' A' ' 106' ' ' ILE . . . 88.98 47.02 4.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.549 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.57 HD13 ' O ' ' A' ' 105' ' ' GLY . 21.7 mm -133.38 91.21 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 0.0 111.078 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 27.3 p -54.64 119.82 5.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.953 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.589 ' HE1' HG23 ' A' ' 102' ' ' THR . 14.6 p90 -117.5 74.24 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.873 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.29 39.81 2.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.759 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -121.49 -47.03 2.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.013 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.16 33.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.039 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -116.66 90.1 3.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.987 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.84 -76.67 0.15 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.04 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.541 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -147.21 -39.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.417 ' HA ' HG22 ' A' ' 118' ' ' ILE . . . -77.57 -22.12 51.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 110.658 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 12.7 mm-40 -85.58 -37.96 18.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.85 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.864 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -82.37 -19.89 38.28 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.302 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.864 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.64 -25.24 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.589 177.749 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.72 -35.38 19.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.392 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -33.51 74.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.456 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.258 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.913 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.524 0.202 . . . . 0.0 110.467 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.586 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -144.9 135.29 24.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.675 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -89.74 119.98 30.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.835 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.88 156.0 10.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.905 0.383 . . . . 0.0 111.759 -177.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.22 117.48 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.069 0.461 . . . . 0.0 110.718 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 12' ' ' VAL . 27.1 m -93.14 110.37 23.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.166 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -91.86 111.54 23.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.301 0.572 . . . . 0.0 111.595 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 22.8 p-10 . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.841 0.353 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.431 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 0.9 OUTLIER -125.0 135.48 52.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.411 179.795 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.5 m -87.11 145.5 26.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.343 0.592 . . . . 0.0 111.069 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.918 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -114.26 140.2 48.78 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.981 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.918 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.17 157.55 37.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.005 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.913 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.38 106.43 2.93 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.769 0.795 . . . . 0.0 111.168 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 35' ' ' ALA . 5.0 t -124.53 167.61 18.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 114.36 -1.291 . . . . 0.0 110.705 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.506 ' N ' HG12 ' A' ' 37' ' ' VAL . 0.7 OUTLIER -55.51 -64.95 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.433 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -160.25 -16.37 0.05 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.6 m -42.19 -38.14 1.65 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.883 HE22 HG22 ' A' ' 55' ' ' ILE . 1.4 pp0? -63.22 -53.38 54.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.911 0.386 . . . . 0.0 111.309 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.0 tp -57.78 -28.31 63.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.511 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -90.41 -40.47 12.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.683 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.6 tm0? -62.21 -40.73 97.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.808 0.337 . . . . 0.0 110.756 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.772 HD12 ' CG2' ' A' ' 53' ' ' VAL . 7.3 mt -78.84 -39.83 34.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.257 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -65.98 -12.89 58.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.537 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.46 -28.84 2.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.681 0.277 . . . . 0.0 111.504 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -129.48 110.02 17.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.13 -22.66 11.32 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.655 2.237 . . . . 0.0 112.654 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -45.79 -63.7 0.91 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.879 0.371 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.02 170.4 16.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.8 t -119.44 108.28 23.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.884 0.373 . . . . 0.0 111.679 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.772 ' CG2' HD12 ' A' ' 45' ' ' LEU . 1.5 p -105.89 111.32 34.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.494 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.546 ' O ' HG22 ' A' ' 10' ' ' VAL . 16.0 mt-30 -127.52 130.9 49.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.583 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.883 HG22 HE22 ' A' ' 41' ' ' GLN . 2.6 pp -88.13 145.35 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.064 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.1 p . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.684 179.723 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.0 tp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.696 0.284 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -49.05 -47.2 45.01 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.437 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.5 p -62.33 -9.31 7.74 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.407 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 4.7 m-85 -100.16 137.27 38.83 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.602 0.239 . . . . 0.0 110.504 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.462 ' C ' HD11 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -123.17 -96.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.708 -0.223 . . . . 0.0 111.555 -179.591 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.924 ' HA ' HD21 ' A' ' 97' ' ' LEU . 4.2 m -142.97 -34.03 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -83.27 -20.47 34.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.257 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.414 ' O ' ' CB ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -83.34 -38.19 22.39 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.924 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -73.3 -46.28 50.51 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.355 -179.392 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.595 ' H ' HD22 ' A' ' 97' ' ' LEU . 3.1 ttmt -60.86 -37.29 81.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.885 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.28 -24.22 27.82 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 61.6 tt0 -86.82 -43.7 12.29 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.202 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 1.057 HD22 HG21 ' A' ' 106' ' ' ILE . 2.8 mt -55.7 -47.48 76.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.151 0.501 . . . . 0.0 110.121 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -42.06 98.25 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.246 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -8.15 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.041 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.72 -15.32 18.54 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.9 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.75 51.36 2.88 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.972 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 1.057 HG21 HD22 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -133.43 88.6 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.925 0.393 . . . . 0.0 111.022 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 156.27 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.091 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.814 ' HB3' ' HB3' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -142.76 -105.74 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.829 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.11 33.05 1.01 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.735 0.302 . . . . 0.0 111.556 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.86 -35.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.238 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 11.2 t -111.82 -32.17 6.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.08 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.814 ' HB3' ' HB3' ' A' ' 108' ' ' PHE . . . -114.09 119.81 38.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.903 0.382 . . . . 0.0 111.262 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -112.9 -55.58 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.531 ' HD3' HG12 ' A' ' 94' ' ' VAL . 0.0 OUTLIER -166.25 -39.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.629 179.549 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.11 -22.27 33.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.939 0.399 . . . . 0.0 110.632 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.677 ' O ' HD13 ' A' ' 120' ' ' LEU . 2.1 mt-10 -85.96 -38.11 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.954 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -80.65 -21.18 41.64 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.342 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.954 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -84.52 -28.36 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.933 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.03 -34.1 19.32 Favored 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.385 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.677 HD13 ' O ' ' A' ' 116' ' ' GLU . 2.0 mp -55.4 -34.1 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.402 -179.193 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.543 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 8.8 m-85 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.73 -179.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.76 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 13.6 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.048 0.451 . . . . 0.0 110.732 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.58 146.79 29.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.323 -179.575 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -89.04 124.65 34.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.676 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -110.37 153.6 12.1 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-O 121.322 0.582 . . . . 0.0 112.255 -178.06 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.2 p -138.68 123.73 22.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.197 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.892 ' CG1' HD13 ' A' ' 45' ' ' LEU . 35.6 m -93.37 108.87 21.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.966 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.408 ' O ' HG22 ' A' ' 52' ' ' VAL . 9.8 mt-30 -90.0 106.52 18.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.104 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.457 ' HB2' HG22 ' A' ' 11' ' ' VAL . 2.7 p30 . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 m-80 -122.41 145.75 47.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.052 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.31 145.31 26.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.469 0.652 . . . . 0.0 111.906 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.925 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -114.28 139.41 49.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.641 179.526 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.925 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -71.28 155.26 40.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.089 0.471 . . . . 0.0 110.612 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.76 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.23 114.37 9.23 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.327 0.584 . . . . 0.0 112.013 -178.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.689 HG22 ' HG3' ' A' ' 41' ' ' GLN . 0.8 OUTLIER -126.09 -171.66 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.232 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.676 ' N ' HG23 ' A' ' 37' ' ' VAL . 2.0 m -89.97 57.59 3.87 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' A' ' 41' ' ' GLN . 2.9 tt0 78.51 -16.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.413 ' HB3' HG21 ' A' ' 37' ' ' VAL . 0.3 OUTLIER -52.91 -21.51 4.39 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.344 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.689 ' HG3' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -79.96 -28.3 39.61 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.088 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HA ' HG21 ' A' ' 53' ' ' VAL . 3.5 tp -83.51 -31.78 26.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.018 0.437 . . . . 0.0 110.901 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.66 -29.07 22.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.02 -40.35 82.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.121 0.486 . . . . 0.0 109.986 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.983 HD12 HG23 ' A' ' 53' ' ' VAL . 49.0 mt -78.82 -39.58 35.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.782 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -28.04 67.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.031 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.32 -29.88 25.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.337 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.82 118.15 47.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.784 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -85.35 42.67 1.11 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.764 2.309 . . . . 0.0 112.765 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mtp85 -119.79 -38.78 2.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.741 0.305 . . . . 0.0 110.625 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.641 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -101.46 -179.11 3.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.179 179.233 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 13' ' ' GLN . 4.7 m -117.99 137.4 52.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.695 0.283 . . . . 0.0 111.626 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.983 HG23 HD12 ' A' ' 45' ' ' LEU . 4.0 p -125.96 113.1 32.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.094 0.474 . . . . 0.0 110.962 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.676 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.8 mt-30 -127.66 135.57 50.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.325 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.533 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.5 pp -88.56 113.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.491 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.674 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 tp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.797 0.332 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -48.95 -42.77 38.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.464 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 35.3 m -61.89 -15.7 44.8 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -94.16 91.12 6.63 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 120.889 0.376 . . . . 0.0 110.227 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.3 p -65.09 -105.41 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.748 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.797 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 16.1 t -132.56 -56.48 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.876 0.369 . . . . 0.0 111.601 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.42 -19.78 66.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.113 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.17 -21.44 36.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.214 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -74.39 -58.68 3.14 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.797 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.3 ptpt -59.75 -29.83 68.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.667 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.53 -25.71 28.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.077 0.465 . . . . 0.0 111.75 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -86.73 -36.25 18.75 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.668 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.499 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 7.8 mt -58.54 -48.13 81.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.221 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.455 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -67.45 -38.49 84.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.965 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.97 -6.7 55.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.185 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.426 ' HG2' HD11 ' A' ' 106' ' ' ILE . 3.4 ttm-85 -102.79 -15.27 16.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.266 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.4 36.99 4.17 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.634 -0.794 . . . . 0.0 112.863 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.435 ' HB ' HD22 ' A' ' 101' ' ' LEU . 3.9 mp -141.56 91.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.72 0.295 . . . . 0.0 111.201 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.8 t -59.96 159.59 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.971 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.455 ' HE1' HG23 ' A' ' 102' ' ' THR . 1.8 p90 -150.14 72.82 1.13 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.691 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -66.02 -67.98 0.4 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.083 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -140.6 32.93 1.83 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -111.67 -34.3 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.877 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.632 ' HB1' ' HB3' ' A' ' 117' ' ' LEU . . . -119.84 85.5 2.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.891 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.475 ' O ' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.28 -85.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.114 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.731 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -140.44 -37.18 0.46 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.477 ' N ' ' HG2' ' A' ' 114' ' ' LYS . . . -83.18 -23.81 32.74 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.9 mt-10 -85.82 -36.88 19.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.357 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.922 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -80.09 -19.64 46.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.93 -179.655 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.922 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.59 -28.13 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.06 -33.56 19.48 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.998 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.6 tp -49.24 -41.03 36.2 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.085 -179.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.499 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 20.9 m-85 . . . . . 0 C--N 1.327 -0.411 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.217 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.887 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.654 0.264 . . . . 0.0 110.952 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.487 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.05 143.26 30.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.404 0.621 . . . . 0.0 112.493 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.5 p -95.54 121.67 37.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.71 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.8 150.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.025 0.441 . . . . 0.0 111.228 -179.005 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.2 p -135.82 124.54 38.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.298 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.567 HG13 ' HG ' ' A' ' 45' ' ' LEU . 11.3 m -93.14 104.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.369 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.36 108.02 19.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.628 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.651 ' ND2' HD12 ' A' ' 51' ' ' LEU . 8.4 t30 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.189 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 p30 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.828 0.347 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.457 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 42.4 m-20 -116.34 124.46 50.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.617 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.16 145.62 26.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.464 0.649 . . . . 0.0 111.464 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.966 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -113.41 139.9 48.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.331 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.966 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.29 157.58 37.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.161 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.887 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.46 111.44 5.32 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.761 0.791 . . . . 0.0 111.214 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.542 ' N ' HG22 ' A' ' 7' ' ' THR . 4.5 t -127.6 168.3 20.98 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.461 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.513 ' H ' HG12 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -52.75 -69.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.742 0.306 . . . . 0.0 111.367 179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -156.71 -16.6 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 87.6 p -42.47 -44.52 4.09 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.88 HE22 ' CG2' ' A' ' 55' ' ' ILE . 2.8 pp0? -55.72 -47.03 77.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.807 0.337 . . . . 0.0 111.721 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.456 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 6.7 tp -49.24 -55.41 12.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.469 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.87 -27.9 61.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.18 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -51.77 68.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.662 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.567 ' HG ' HG13 ' A' ' 12' ' ' VAL . 2.9 mm? -78.82 -44.19 23.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.875 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -63.05 -17.71 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.245 179.885 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.77 -67.72 0.25 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.85 0.357 . . . . 0.0 111.56 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.91 133.58 41.04 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -84.98 48.64 2.38 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.689 2.259 . . . . 0.0 112.566 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.67 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER -111.42 -38.43 4.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.85 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.708 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -112.96 -176.51 2.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.728 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 m -116.34 128.57 73.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.213 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.471 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 3.3 p -116.09 116.27 51.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.09 120.65 29.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.239 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.88 ' CG2' HE22 ' A' ' 41' ' ' GLN . 1.1 pt -88.36 139.26 17.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.24 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.611 179.762 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.645 HD12 ' O ' ' A' ' 118' ' ' ILE . 2.5 mm? . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.752 0.31 . . . . 0.0 111.105 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -49.02 -45.81 43.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.512 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -13.91 31.2 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -106.17 144.8 32.36 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 110.71 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.413 ' O ' HD21 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -98.98 -104.67 0.21 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.974 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.555 ' HA ' HD11 ' A' ' 97' ' ' LEU . 2.9 m -144.86 -38.71 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.763 0.316 . . . . 0.0 111.17 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -82.11 -21.2 36.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.461 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.2 OUTLIER -70.28 -52.35 23.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.289 0.566 . . . . 0.0 109.754 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.693 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.81 -57.91 7.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.53 179.185 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.723 ' HE2' HD11 ' A' ' 117' ' ' LEU . 1.8 ttmt -54.3 -36.78 64.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.544 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.89 -22.19 29.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.944 0.402 . . . . 0.0 112.001 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.457 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -87.0 -39.1 15.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.275 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.572 HD23 ' CZ ' ' A' ' 121' ' ' PHE . 1.4 mt -59.68 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.165 0.507 . . . . 0.0 110.034 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.554 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -64.33 -40.03 95.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.35 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.49 -6.56 53.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.289 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -100.18 -15.24 18.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.158 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.3 28.86 9.36 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.481 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.0 mt -121.95 88.43 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.762 0.315 . . . . 0.0 111.038 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 72.8 p -58.46 140.38 54.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.554 ' HE1' HG23 ' A' ' 102' ' ' THR . 15.5 p90 -138.78 74.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.24 -71.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -122.27 28.04 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.07 -31.79 6.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.922 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.546 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -134.51 107.31 7.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -79.89 -80.15 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.072 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.641 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -141.74 -37.91 0.4 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.797 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.59 -21.16 38.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.877 0.37 . . . . 0.0 110.563 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 46.7 mm-40 -85.74 -38.85 17.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.705 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.735 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -79.89 -19.34 48.41 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.486 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.807 ' O ' HD13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -83.25 -27.73 7.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.823 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.78 -33.13 18.76 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.988 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.525 HD23 HD11 ' A' ' 101' ' ' LEU . 18.1 tp -49.05 -44.15 41.49 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.306 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CZ ' HD23 ' A' ' 101' ' ' LEU . 96.2 m-85 . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.296 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.793 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.262 0 CA-C-O 121.009 0.433 . . . . 0.0 110.884 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.535 ' CE2' HD13 ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.4 121.81 10.32 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.417 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.2 p -111.35 127.73 55.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 177.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 1.002 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.84 153.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.08 0.467 . . . . 0.0 111.613 -178.553 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.7 p -138.03 106.54 3.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.849 HG21 HD22 ' A' ' 45' ' ' LEU . 82.2 t -92.48 134.12 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.937 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.401 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 1.1 mt-30 -119.71 108.47 14.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.134 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.393 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.404 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.1 t-20 -122.87 128.02 49.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.589 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 61.4 m -87.26 145.44 26.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.131 0.491 . . . . 0.0 111.506 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.847 HD13 ' O ' ' A' ' 35' ' ' ALA . 2.7 tm? -102.9 153.73 19.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.674 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.847 ' O ' HD13 ' A' ' 34' ' ' LEU . . . -71.18 157.85 37.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 121.601 0.715 . . . . 0.0 112.805 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.793 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.69 104.85 2.97 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.551 0.691 . . . . 0.0 110.843 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.643 HG12 ' H ' ' A' ' 38' ' ' SER . 1.1 t -115.43 -159.45 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.947 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.643 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.9 m -107.74 40.82 1.64 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.725 0.297 . . . . 0.0 111.069 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.45 ' CB ' ' O ' ' A' ' 38' ' ' SER . 3.3 tt0 85.75 -18.58 0.35 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.226 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.0 m -50.44 -34.02 23.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.121 0.486 . . . . 0.0 110.323 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.49 ' NE2' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.32 -44.81 76.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.383 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.455 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -57.24 -55.48 34.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.871 -179.415 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.53 -27.13 63.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -56.87 -51.04 70.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.849 HD22 HG21 ' A' ' 12' ' ' VAL . 0.5 OUTLIER -78.71 -52.96 7.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.665 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.537 ' CA ' HG11 ' A' ' 53' ' ' VAL . 0.3 OUTLIER -53.88 -24.25 15.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.232 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.54 -29.71 1.91 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.437 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -117.85 117.79 35.31 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.763 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.05 68.44 5.8 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.455 2.104 . . . . 0.0 112.27 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mmt-85 -128.26 -43.82 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.101 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 56.6 mt -124.72 142.58 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.982 0.42 . . . . 0.0 111.143 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.29 111.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.348 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.537 HG11 ' CA ' ' A' ' 46' ' ' LYS . 1.4 p -98.56 118.19 44.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.127 0.489 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.77 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -121.9 144.79 48.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.397 -179.219 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 1.002 HG22 HG23 ' A' ' 10' ' ' VAL . 1.8 pp -107.41 144.76 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.231 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 m . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.602 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 92' ' ' PHE . 47.6 tp . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.604 0.24 . . . . 0.0 111.52 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -49.04 -50.23 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.663 0.268 . . . . 0.0 111.408 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -1.3 9.82 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.505 ' HB2' HD12 ' A' ' 89' ' ' LEU . 2.4 m-85 -95.06 104.68 16.56 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.815 ' O ' HD21 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -123.79 -92.41 0.53 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.965 HG12 ' HZ1' ' A' ' 98' ' ' LYS . 2.0 t -125.5 -50.79 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-O 120.884 0.373 . . . . 0.0 111.773 -179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.34 -19.39 39.41 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.07 -25.97 29.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.828 HD13 ' N ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -81.77 -53.26 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.509 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.965 ' HZ1' HG12 ' A' ' 94' ' ' VAL . 4.7 ptpt -57.92 -29.74 65.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.116 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.71 -25.47 28.34 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 16.2 mt-30 -86.87 -32.83 20.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.459 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 9.4 mt -61.14 -48.87 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -38.08 86.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.968 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -75.46 -6.89 52.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.957 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -113.72 13.74 18.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.007 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 58.48 60.79 8.28 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.748 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.2 mt -144.78 96.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.679 0.276 . . . . 0.0 111.18 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.3 p -52.72 149.63 5.97 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.786 0.327 . . . . 0.0 111.105 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -72.66 -50.93 21.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.808 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.14 160.45 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.988 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.15 76.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -178.36 -39.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.656 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -82.59 59.31 4.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.007 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.5 -71.9 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.227 -179.806 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.67 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -153.62 -41.25 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.579 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.85 -22.62 36.88 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.043 0.449 . . . . 0.0 110.199 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 81.6 mm-40 -85.94 -38.07 18.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.62 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.982 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.05 -24.07 51.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.335 -179.12 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.982 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.29 -26.57 7.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.182 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.98 -35.16 19.0 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.239 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 14.3 tp -50.33 -46.65 55.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.894 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.505 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 20.5 m-85 . . . . . 0 C--N 1.33 -0.281 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.895 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.46 0.075 0 CA-C-O 120.673 0.273 . . . . 0.0 110.392 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.484 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.01 145.91 31.7 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.276 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.9 p -96.18 126.43 41.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.685 HG11 HD12 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -109.89 150.68 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.109 0.481 . . . . 0.0 111.369 -178.872 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.4 p -136.98 131.14 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.682 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.001 HG13 HD13 ' A' ' 45' ' ' LEU . 6.7 m -98.39 104.59 16.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.436 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -104.6 106.71 17.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.521 ' OD1' HG13 ' A' ' 52' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.086 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.865 0.364 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.568 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 42.4 t-20 -119.46 127.59 53.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.208 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.97 145.21 26.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.427 0.632 . . . . 0.0 111.576 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.913 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.15 141.8 44.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.841 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.913 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.69 156.72 39.12 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 120.998 0.428 . . . . 0.0 110.575 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.27 114.26 8.24 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.357 0.599 . . . . 0.0 111.32 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.695 HG23 ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -131.82 -170.81 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.936 -179.49 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.695 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -66.67 -71.43 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -160.57 -18.15 0.05 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.6 p -42.85 -38.3 2.12 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.74 0.305 . . . . 0.0 111.813 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.709 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -58.56 -42.1 87.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.755 -179.735 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.55 HD13 HG23 ' A' ' 55' ' ' ILE . 5.4 tp -71.54 -30.3 65.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.415 -179.118 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.494 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -89.32 -27.97 20.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.588 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -69.82 -46.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.89 0.376 . . . . 0.0 110.637 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 1.001 HD13 HG13 ' A' ' 12' ' ' VAL . 65.7 mt -78.91 -31.57 45.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.176 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.52 ' HB2' HG11 ' A' ' 53' ' ' VAL . 13.1 tttt -83.29 -15.7 49.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.298 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.494 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -48.51 -39.46 23.35 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.683 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -121.01 142.63 35.13 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -84.12 50.7 3.15 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.723 2.282 . . . . 0.0 112.522 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.832 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -97.79 -49.69 4.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.536 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.832 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -125.26 -171.22 2.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.938 179.3 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.554 ' O ' HG12 ' A' ' 12' ' ' VAL . 2.6 m -110.71 143.14 21.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 111.927 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.52 HG11 ' HB2' ' A' ' 46' ' ' LYS . 3.2 p -131.43 117.6 36.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.192 178.787 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.578 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -127.46 135.06 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.068 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.591 HG22 HE22 ' A' ' 41' ' ' GLN . 1.0 OUTLIER -88.63 120.35 37.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.843 179.231 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 70.8 p . . . . . 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.875 -179.981 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.75 HD11 ' O ' ' A' ' 118' ' ' ILE . 18.6 tp . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.824 0.345 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -48.84 -30.39 5.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.741 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 t -62.05 -13.1 22.85 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.584 ' HB3' HD23 ' A' ' 97' ' ' LEU . 22.1 m-85 -108.06 159.87 16.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.633 0.254 . . . . 0.0 110.738 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.621 HG22 HG23 ' A' ' 94' ' ' VAL . 65.2 m -118.38 -97.86 0.46 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.609 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.726 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.2 t -139.05 -52.91 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.059 0 CA-C-O 121.198 0.523 . . . . 0.0 111.347 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -72.74 -19.85 61.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.8 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -80.68 -36.41 32.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 120.852 0.358 . . . . 0.0 110.893 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.726 HD11 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -63.32 -58.35 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.317 0.58 . . . . 0.0 109.981 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.622 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 3.3 ptpt -55.06 -33.59 62.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.335 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.74 -22.01 29.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.066 0.46 . . . . 0.0 111.443 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.571 ' NE2' ' CE1' ' A' ' 92' ' ' PHE . 7.7 mt-30 -87.09 -36.8 17.93 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.907 HD21 HD12 ' A' ' 120' ' ' LEU . 9.0 mt -59.45 -48.68 80.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.199 0.523 . . . . 0.0 110.148 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -37.52 83.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.596 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.14 -6.57 59.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.265 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 -100.12 -15.22 18.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.169 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.55 -2.89 21.8 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.006 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.472 ' HB ' HD22 ' A' ' 101' ' ' LEU . 2.9 mt -109.93 78.38 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.909 0.385 . . . . 0.0 111.113 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.445 HG23 ' O ' ' A' ' 107' ' ' THR . 3.5 t -82.17 90.99 6.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.501 ' HE2' HD12 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.04 -177.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.107 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 9.9 mttm -148.46 -51.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.58 30.25 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.894 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -116.72 -37.48 3.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.497 ' HB3' ' HD2' ' A' ' 108' ' ' PHE . . . -100.99 99.86 10.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.886 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -80.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.241 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.677 ' HA ' HD22 ' A' ' 117' ' ' LEU . 8.3 ptmt -143.01 -38.9 0.34 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.734 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.05 -23.13 38.77 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -85.81 -36.86 19.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.755 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.953 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.0 -22.67 39.24 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.371 -179.419 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.953 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.41 -28.14 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.073 178.644 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.61 -33.17 18.94 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 121.209 0.528 . . . . 0.0 110.826 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.907 HD12 HD21 ' A' ' 101' ' ' LEU . 1.4 tm? -49.12 -51.21 33.32 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.692 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.538 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 40.8 m-85 . . . . . 0 C--N 1.332 -0.194 0 CA-C-O 120.703 0.287 . . . . 0.0 110.982 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.78 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.613 0.244 . . . . 0.0 110.554 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.515 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -144.79 143.53 30.7 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.569 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -89.36 125.12 35.0 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.873 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.731 ' CG1' HD12 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -110.31 149.11 13.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.364 0.602 . . . . 0.0 112.011 -178.395 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.5 p -138.6 126.67 28.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.452 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.051 HG13 HD13 ' A' ' 45' ' ' LEU . 16.9 m -93.82 104.69 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.549 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.88 106.56 18.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.427 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.567 ' ND2' HD12 ' A' ' 51' ' ' LEU . 1.8 t30 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.07 0.462 . . . . 0.0 111.09 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.495 ' HB2' HG22 ' A' ' 11' ' ' VAL . 37.3 p-10 . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 120.921 0.391 . . . . 0.0 111.297 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.8 m-20 -119.16 137.86 53.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.079 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.19 145.08 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.359 0.599 . . . . 0.0 111.484 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.894 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -115.07 143.4 45.25 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.93 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.894 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.33 157.38 37.84 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 121.179 0.514 . . . . 0.0 111.044 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.78 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.56 111.34 5.32 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.686 0.755 . . . . 0.0 111.987 -177.46 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.726 HG12 ' H ' ' A' ' 38' ' ' SER . 2.3 t -129.93 179.67 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.489 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.726 ' H ' HG12 ' A' ' 37' ' ' VAL . 0.6 OUTLIER -104.79 72.61 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -179.127 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 78.52 -16.65 0.65 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 178.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 t -62.58 -21.37 65.56 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.577 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -84.61 -25.77 28.35 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.376 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.539 HD12 HG22 ' A' ' 53' ' ' VAL . 7.5 tp -74.36 -54.72 7.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.96 0.41 . . . . 0.0 110.977 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.63 -21.48 66.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.184 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -48.38 21.61 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 1.051 HD13 HG13 ' A' ' 12' ' ' VAL . 59.1 mt -78.83 -30.75 45.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.284 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.452 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -77.28 -10.26 59.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.373 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.69 -47.94 29.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.794 0.331 . . . . 0.0 111.44 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.5 123.08 64.8 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -80.6 55.28 5.61 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.579 2.186 . . . . 0.0 112.455 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -135.58 -43.07 0.68 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.704 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -90.97 -176.5 4.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.52 108.83 19.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.775 0.321 . . . . 0.0 111.599 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.539 HG22 HD12 ' A' ' 42' ' ' LEU . 1.8 p -98.93 111.77 29.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.195 0.521 . . . . 0.0 110.295 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.629 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.7 mt-30 -127.04 144.66 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.295 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.492 HG22 HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -100.03 133.13 44.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.353 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.782 179.967 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.527 0.061 0 CA-C-O 120.805 0.336 . . . . 0.0 110.971 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -48.82 -41.79 34.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.341 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.87 -13.78 27.68 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.439 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 6.2 m-85 -106.29 104.53 14.25 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 66.5 p -89.44 -85.54 0.2 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.997 -178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.712 ' HA ' HD22 ' A' ' 97' ' ' LEU . 24.2 t -145.5 -56.52 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.957 0.408 . . . . 0.0 111.309 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -73.44 -19.25 61.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.005 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -81.99 -20.8 37.76 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.734 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.712 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -78.5 -58.27 3.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.656 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.4 ptpt -55.34 -29.66 58.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.345 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.81 -30.32 24.65 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.064 0.459 . . . . 0.0 112.022 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 121' ' ' PHE . 3.9 mm-40 -86.5 -22.02 26.64 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.696 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.796 HD13 ' CD1' ' A' ' 106' ' ' ILE . 1.2 mt -76.87 -42.2 40.81 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.333 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.405 ' HA ' ' CG2' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -64.29 -43.39 94.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.377 179.686 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -6.33 53.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.176 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.469 ' HG2' ' O ' ' A' ' 104' ' ' ARG . 0.7 OUTLIER -108.56 -15.46 14.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.153 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.669 ' O ' HG22 ' A' ' 106' ' ' ILE . . . 144.25 -54.6 0.57 Allowed Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.179 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.951 HD11 ' CD2' ' A' ' 108' ' ' PHE . 9.4 tp 52.27 136.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-O 121.457 0.646 . . . . 0.0 112.725 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 18.1 p -156.36 26.68 0.35 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.545 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.951 ' CD2' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.82 87.52 0.14 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.644 -179.535 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -67.14 70.9 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 51.28 27.3 3.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.6 p -117.43 -29.23 5.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.268 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.752 ' HB3' ' CB ' ' A' ' 108' ' ' PHE . . . -85.22 76.05 10.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.81 0.338 . . . . 0.0 111.386 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -70.59 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.983 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.795 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.1 mttp -154.09 -42.24 0.09 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.73 0.3 . . . . 0.0 111.477 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.29 -23.9 40.39 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.926 0.393 . . . . 0.0 110.143 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.8 mt-10 -85.97 -37.37 19.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.452 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.88 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -77.88 -19.82 54.1 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.913 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.88 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -82.85 -27.85 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.997 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.3 -34.74 18.77 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.84 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 tp -49.9 -40.43 42.97 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.447 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.526 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 6.0 m-85 . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.287 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.842 HG22 ' C ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.675 0.274 . . . . 0.0 110.646 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.504 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.23 144.67 30.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.366 0.603 . . . . 0.0 112.619 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.69 130.06 36.02 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.638 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.737 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.24 152.61 12.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 112.079 -178.557 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.5 p -138.47 102.1 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.316 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.847 HG21 HD13 ' A' ' 45' ' ' LEU . 42.9 t -92.49 130.25 41.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.18 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -125.0 106.62 10.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.866 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.694 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.768 0.318 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.43 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 10.1 m-20 -126.38 131.78 51.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.236 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.4 m -87.22 145.76 26.26 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.167 0.508 . . . . 0.0 111.162 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.946 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -115.34 141.16 48.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.118 -179.847 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.946 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.67 157.3 38.23 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.9 0.381 . . . . 0.0 110.219 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.842 ' C ' HG22 ' A' ' 7' ' ' THR . . . -69.2 114.58 7.59 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.742 0.782 . . . . 0.0 111.352 -177.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 38' ' ' SER . 11.1 t -127.79 167.91 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.775 -179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.542 ' N ' HG12 ' A' ' 37' ' ' VAL . 0.3 OUTLIER -53.39 -53.71 47.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.595 -179.93 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.74 -20.62 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.38 -33.1 0.6 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.825 0.345 . . . . 0.0 111.473 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.616 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.1 -57.85 11.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.771 179.618 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.44 HD13 HG23 ' A' ' 55' ' ' ILE . 8.8 tp -53.05 -55.47 23.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.874 -178.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -67.33 -30.94 70.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -53.08 -54.62 32.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.364 . . . . 0.0 110.661 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.847 HD13 HG21 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -79.07 -54.45 5.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.062 179.783 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.652 ' N ' HG11 ' A' ' 53' ' ' VAL . 11.7 tttt -49.26 -25.94 2.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.511 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -45.19 -30.2 1.13 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.541 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -112.5 121.73 38.17 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.774 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -77.19 69.58 7.05 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.468 2.112 . . . . 0.0 112.266 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.35 -40.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.173 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.711 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -100.22 124.45 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.754 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.501 ' O ' HG13 ' A' ' 12' ' ' VAL . 3.5 t -69.7 106.11 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.999 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.652 HG11 ' N ' ' A' ' 46' ' ' LYS . 2.0 p -107.13 117.73 53.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.703 178.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.727 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.07 142.96 51.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.084 -178.665 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.526 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.2 pt -93.8 126.78 46.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.28 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.59 179.692 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.703 HD12 ' O ' ' A' ' 118' ' ' ILE . 3.0 mm? . . . . . 0 CA--C 1.525 0.018 0 CA-C-O 120.856 0.36 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -54.62 -50.28 68.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.332 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.8 m -62.41 -14.63 42.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.48 ' HB3' HD11 ' A' ' 118' ' ' ILE . 4.3 m-85 -71.75 -14.45 62.01 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 122.24 -0.287 . . . . 0.0 111.26 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.757 ' O ' HD11 ' A' ' 97' ' ' LEU . 0.2 OUTLIER 57.74 -148.72 0.48 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.968 179.293 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.689 ' O ' HD22 ' A' ' 97' ' ' LEU . 4.0 m -127.44 -32.08 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.166 0.508 . . . . 0.0 110.993 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.6 -19.55 38.18 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.441 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -23.6 40.13 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.823 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 1.01 HD13 ' H ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.78 -48.92 8.91 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.18 179.8 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HE3' ' CD2' ' A' ' 117' ' ' LEU . 0.8 OUTLIER -57.89 -35.67 71.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.611 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.16 -23.97 28.15 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.501 ' HG2' ' CE1' ' A' ' 121' ' ' PHE . 1.0 OUTLIER -86.52 -37.89 17.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.664 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.795 HD12 ' CD1' ' A' ' 117' ' ' LEU . 1.9 mt -59.34 -46.98 87.13 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.479 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -59.93 -43.08 95.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.961 179.297 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -72.62 -6.78 46.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.051 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -105.98 -15.43 14.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.87 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 63.05 63.85 4.25 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.725 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.668 ' HB ' HD22 ' A' ' 101' ' ' LEU . 48.5 mm -116.59 -86.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.587 0.194 . . . . 0.0 111.109 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.657 HG22 HG22 ' A' ' 106' ' ' ILE . 1.3 t 169.88 150.13 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.479 ' CZ ' HG23 ' A' ' 102' ' ' THR . 13.4 p90 -171.89 92.27 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.971 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -176.79 135.4 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.883 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 68.84 -67.11 0.22 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.873 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.3 p -65.88 -68.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.71 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.562 ' O ' HG23 ' A' ' 113' ' ' THR . . . -79.98 179.56 7.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.965 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.562 HG23 ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -172.34 -80.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.749 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.407 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -138.21 -57.49 0.65 Allowed 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.422 179.676 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.71 -35.03 79.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.148 0.499 . . . . 0.0 109.954 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -86.84 -33.95 19.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.756 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.795 ' CD1' HD12 ' A' ' 101' ' ' LEU . 1.7 tp -74.67 -37.47 62.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.896 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.703 ' O ' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -77.56 -28.31 15.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.101 179.651 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.75 -32.5 20.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 121.077 0.465 . . . . 0.0 110.872 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.7 mt -54.98 -40.36 69.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.641 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.56 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.4 m-85 . . . . . 0 C--N 1.331 -0.218 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.676 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.867 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.582 0.229 . . . . 0.0 110.785 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.536 ' CZ ' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -145.07 137.12 25.77 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.7 p -87.91 124.41 33.65 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.801 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.02 157.72 10.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 CA-C-O 120.923 0.392 . . . . 0.0 111.385 -178.625 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.4 p -138.51 108.97 4.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.112 0.482 . . . . 0.0 110.537 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.961 HG22 HD13 ' A' ' 45' ' ' LEU . 2.5 t -92.68 135.9 26.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.23 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -116.72 113.34 22.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.757 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.522 ' HB3' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-O 121.039 0.447 . . . . 0.0 110.951 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.773 0.321 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.407 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.5 p30 -114.73 123.39 49.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.848 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -87.44 145.73 26.15 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.331 0.586 . . . . 0.0 111.629 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.951 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.5 OUTLIER -114.91 139.08 50.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.945 179.671 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.951 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.8 156.4 39.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.867 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.63 116.73 11.29 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.415 0.626 . . . . 0.0 111.384 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.66 HG23 ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -130.19 -171.69 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.849 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.66 ' N ' HG23 ' A' ' 37' ' ' VAL . 44.3 p -59.77 -58.63 7.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.172 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 179.88 -16.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.4 t -42.54 -34.76 0.91 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.821 HE22 HG22 ' A' ' 55' ' ' ILE . 2.4 pp0? -58.9 -48.75 80.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.843 0.354 . . . . 0.0 111.356 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.526 HD13 HG21 ' A' ' 55' ' ' ILE . 9.3 tp -55.55 -50.11 70.91 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.406 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -77.25 -29.67 54.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.444 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -58.59 -46.57 86.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.119 0.485 . . . . 0.0 110.15 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.961 HD13 HG22 ' A' ' 12' ' ' VAL . 4.5 mt -78.95 -48.15 15.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.704 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.418 ' CA ' HG11 ' A' ' 53' ' ' VAL . 1.5 ttmm -64.12 -16.72 62.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.291 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.53 -41.94 14.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.807 0.337 . . . . 0.0 111.462 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.83 121.37 51.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.84 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.54 62.6 6.33 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.57 2.18 . . . . 0.0 112.3 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.78 -46.14 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 14' ' ' ASN . 44.6 mt -92.26 144.49 25.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.993 0.425 . . . . 0.0 111.187 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.69 108.18 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.935 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.623 HG23 HD12 ' A' ' 45' ' ' LEU . 1.3 p -104.66 121.39 56.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.971 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.705 ' O ' HG22 ' A' ' 10' ' ' VAL . 9.0 pm0 -126.92 133.39 50.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.635 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.821 HG22 HE22 ' A' ' 41' ' ' GLN . 1.1 pt -97.98 131.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.446 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.3 m . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.459 179.523 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.473 HD12 HD11 ' A' ' 118' ' ' ILE . 4.1 mm? . . . . . 0 CA--C 1.528 0.114 0 CA-C-O 120.617 0.246 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -49.06 -50.29 37.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.393 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 t -62.19 -15.08 44.09 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -114.22 103.5 11.16 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.697 0.284 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.445 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -94.55 -80.87 0.4 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.593 -179.579 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.753 ' HA ' HD22 ' A' ' 97' ' ' LEU . 28.1 t -147.33 -56.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.81 0.338 . . . . 0.0 111.302 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -19.59 60.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.981 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -82.65 -21.28 35.05 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.514 -179.362 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.753 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -75.6 -58.47 3.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -57.12 -29.13 63.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.29 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.9 23.95 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 7.3 mm-40 -84.17 -28.01 27.67 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.216 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.944 HD22 ' HA ' ' A' ' 106' ' ' ILE . 1.1 mt -69.78 -45.73 67.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.849 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.489 ' HA ' ' HB ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -57.33 -45.29 84.4 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.373 179.541 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -75.52 -6.32 49.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.413 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -114.76 24.17 12.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.599 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.61 -32.09 6.87 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.743 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.944 ' HA ' HD22 ' A' ' 101' ' ' LEU . 0.5 OUTLIER 43.9 96.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 112.106 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -118.16 28.23 8.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.512 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.917 ' CE2' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -69.34 -177.74 1.21 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.096 -179.79 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.43 165.91 12.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.96 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -26.12 42.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.943 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -82.58 0.89 40.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.387 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.82 77.53 0.08 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.785 0.326 . . . . 0.0 111.005 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 70.5 p -77.05 -79.75 0.11 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.979 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.722 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.1 pptp? -146.55 -39.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.667 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.412 ' HA ' HG22 ' A' ' 118' ' ' ILE . . . -80.82 -23.75 38.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.94 0.4 . . . . 0.0 110.714 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -85.92 -37.2 19.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.502 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.891 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.65 -19.33 41.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.947 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.891 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.48 -26.27 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.101 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.52 -34.31 20.04 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.819 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.98 -41.57 64.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.077 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.493 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 4.6 m-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.42 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.497 -0.241 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.35 154.97 51.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.831 0.348 . . . . 0.0 110.979 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -152.64 165.57 34.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.794 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.8 mtp 58.93 29.95 19.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.9 p-10 -165.43 152.92 10.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.907 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.59 79.15 1.19 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.994 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.811 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 6.3 t -112.37 130.25 56.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.782 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.82 152.99 38.59 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -98.88 122.93 42.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.727 HG11 HD12 ' A' ' 45' ' ' LEU . 0.4 OUTLIER -110.22 155.63 11.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.007 0.432 . . . . 0.0 111.873 -178.47 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -135.71 134.91 51.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.113 0.482 . . . . 0.0 111.201 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.811 HG13 HD13 ' A' ' 45' ' ' LEU . 14.1 m -102.36 107.52 22.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.039 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.72 106.46 18.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.613 HD21 ' HB ' ' A' ' 16' ' ' ILE . 53.8 t30 -115.84 146.61 41.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.371 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.658 ' HA ' HD11 ' A' ' 29' ' ' LEU . 15.0 ttt180 -130.08 35.87 4.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.321 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.682 HG22 ' HG2' ' A' ' 17' ' ' LYS . 15.9 mt -84.72 -83.38 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.03 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.847 ' HA ' HD22 ' A' ' 29' ' ' LEU . 7.7 ptpt -158.57 -174.64 4.88 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -102.89 31.57 4.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.909 0.385 . . . . 0.0 110.612 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -153.29 22.61 0.76 Allowed Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.753 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.504 ' CZ ' ' HB3' ' A' ' 27' ' ' PHE . 32.2 p90 -76.79 -17.15 59.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.768 0.318 . . . . 0.0 110.557 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 mmt-85 56.89 -174.46 0.07 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.347 0.594 . . . . 0.0 112.007 178.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.451 ' HG3' ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -169.68 -155.14 0.13 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.174 179.464 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.623 ' HB3' ' HE2' ' A' ' 25' ' ' PHE . . . -42.46 -29.91 0.31 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.722 0.296 . . . . 0.0 111.675 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.36 45.07 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.17 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.623 ' HE2' ' HB3' ' A' ' 23' ' ' ALA . 40.8 m-85 -128.67 21.95 5.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.658 0.266 . . . . 0.0 111.283 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 48.08 45.25 19.47 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.002 0.429 . . . . 0.0 110.946 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 20' ' ' TYR . 3.3 m-30 -49.16 115.55 1.34 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.242 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -87.7 172.17 9.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.089 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.847 HD22 ' HA ' ' A' ' 17' ' ' LYS . 2.4 tp -75.11 100.46 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.685 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 165.69 -152.71 22.23 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.589 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER -109.29 129.1 55.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.872 0.368 . . . . 0.0 111.01 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.557 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.7 t-20 -116.36 130.53 56.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.1 m -86.96 145.14 26.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.455 0.645 . . . . 0.0 111.625 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.942 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.41 142.14 44.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.865 179.717 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.942 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.34 157.56 37.53 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.11 0.481 . . . . 0.0 110.773 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.811 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -69.2 105.15 2.4 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.764 0.792 . . . . 0.0 111.095 -177.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 35' ' ' ALA . 5.6 t -123.66 166.48 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.047 0 CA-C-N 114.205 -1.362 . . . . 0.0 110.617 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.491 ' N ' HG12 ' A' ' 37' ' ' VAL . 11.3 t -52.09 -73.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.351 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -156.5 -16.69 0.1 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -43.03 -45.88 5.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.879 0.371 . . . . 0.0 111.408 -179.851 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.627 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -44.24 -60.92 1.69 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.204 179.562 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD13 HG23 ' A' ' 55' ' ' ILE . 11.4 tp -52.01 -55.38 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.784 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -35.07 79.08 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' SER . 2.6 tp60 -68.2 -41.8 80.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.852 0.358 . . . . 0.0 111.061 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.811 HD13 HG13 ' A' ' 12' ' ' VAL . 68.2 mt -78.74 -31.24 46.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.61 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -79.64 -29.8 41.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 110.865 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.53 -29.7 59.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.185 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -93.19 110.15 44.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.764 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.85 58.78 6.62 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.514 2.143 . . . . 0.0 112.418 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.59 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER -140.97 -45.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.59 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.2 OUTLIER -107.75 175.35 5.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.545 179.796 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.604 ' O ' HG12 ' A' ' 12' ' ' VAL . 2.9 m -110.67 146.04 16.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.96 0.41 . . . . 0.0 111.984 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.457 HG21 ' HA ' ' A' ' 42' ' ' LEU . 3.2 p -130.82 116.32 33.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.818 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.644 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.0 mm-40 -127.47 131.43 50.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.48 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.633 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.8 pt -88.75 132.3 33.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.586 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 39.1 p -122.26 104.5 9.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.489 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -104.89 92.72 4.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.986 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 58' ' ' THR . 8.6 t -68.33 83.08 0.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 141.57 44.02 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.526 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.0 p -178.52 99.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.76 0.314 . . . . 0.0 110.858 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -98.55 34.25 2.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.09 148.01 29.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.872 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 109.99 -102.76 1.61 Allowed Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.488 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.39 -35.53 4.33 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.476 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 60.72 111.28 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.867 0.365 . . . . 0.0 110.889 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -96.62 28.48 13.27 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.478 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.19 104.55 14.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.807 0.337 . . . . 0.0 110.857 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.7 m -89.3 -46.8 8.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.886 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -71.56 165.89 22.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.886 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.42 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 1.2 tm-20 178.19 -53.21 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.907 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.42 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 48.8 Cg_exo -55.95 -43.9 52.39 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.44 2.093 . . . . 0.0 112.193 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -86.15 167.13 15.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.085 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 129.96 99.61 0.88 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.467 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 t 60.58 80.18 0.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.816 0.341 . . . . 0.0 110.875 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -84.97 129.13 34.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.919 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.29 -44.4 2.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.786 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -137.59 132.38 33.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.911 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.4 mttt -157.7 -65.07 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.92 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 60.85 92.89 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.824 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mp 64.45 -79.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.827 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.12 92.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.1 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -167.59 -56.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.09 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -141.19 138.0 17.35 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.816 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.52 134.57 33.5 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.41 2.073 . . . . 0.0 112.214 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.28 -61.8 0.42 Allowed 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.356 2.037 . . . . 0.0 112.314 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m 60.25 31.39 20.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.893 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.8 m -125.09 79.11 1.77 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.957 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -141.78 -61.39 0.46 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.718 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.5 tp -74.87 -31.56 61.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.713 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -44.09 41.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.556 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.88 -14.87 38.01 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -93.66 104.19 16.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.825 0.345 . . . . 0.0 110.521 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.523 HG22 HG23 ' A' ' 94' ' ' VAL . 68.0 m -79.94 -97.61 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.458 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.623 ' HA ' HD11 ' A' ' 97' ' ' LEU . 20.5 t -142.89 -41.85 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.942 0.401 . . . . 0.0 111.246 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -77.77 -20.88 52.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.618 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.89 -51.01 24.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.221 0.534 . . . . 0.0 109.912 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.657 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -50.86 -58.3 6.32 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.904 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.554 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 3.4 ptpt -56.87 -33.31 66.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.727 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.1 -24.15 28.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.982 0.42 . . . . 0.0 112.004 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.478 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 1.3 tp60 -87.09 -37.8 17.08 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.589 HD11 HD22 ' A' ' 120' ' ' LEU . 1.2 mt -60.07 -46.94 87.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.033 0.444 . . . . 0.0 110.081 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -39.83 90.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.179 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.12 -6.58 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.125 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -101.75 -15.34 17.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.14 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.29 39.2 3.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.58 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.443 ' HB ' HD22 ' A' ' 101' ' ' LEU . 29.6 mt -141.58 85.08 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.762 0.315 . . . . 0.0 111.169 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.6 t -62.08 157.92 17.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.823 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.0 p90 -152.39 101.13 2.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.971 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.51 -52.49 2.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.823 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -83.16 -59.1 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.767 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.1 t -88.08 -167.83 2.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.717 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.823 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . 54.65 48.71 19.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.031 0.444 . . . . 0.0 111.087 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.32 -70.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.657 ' HE3' ' HB2' ' A' ' 115' ' ' ALA . 0.0 OUTLIER -157.53 -39.87 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.328 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.657 ' HB2' ' HE3' ' A' ' 114' ' ' LYS . . . -83.12 -21.47 33.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.003 0.43 . . . . 0.0 109.993 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 9.5 mm-40 -85.84 -38.79 17.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.658 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.804 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -78.06 -20.14 52.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.611 -0.435 . . . . 0.0 111.524 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.804 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -28.0 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.779 177.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.58 -31.81 19.66 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.18 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.589 HD22 HD11 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -49.05 -53.11 21.71 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.147 -178.751 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.556 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 88.5 m-85 -55.28 85.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 111.416 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -128.61 131.7 23.92 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.074 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.54 90.33 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.422 2.082 . . . . 0.0 112.321 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -153.6 37.87 0.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.07 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.27 103.56 9.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.881 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 163.77 -81.45 0.12 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.507 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -149.18 -56.78 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.784 0.326 . . . . 0.0 110.853 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -165.73 75.64 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.874 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 11.5 m -90.8 156.81 17.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -130.61 84.25 2.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.051 179.984 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.531 -0.228 . . . . 0.0 112.531 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 p -109.43 -13.44 14.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.646 0.26 . . . . 0.0 111.307 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 64.22 -174.16 0.17 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.805 0.336 . . . . 0.0 110.867 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 67.78 27.84 7.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 57.71 106.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.945 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.11 124.98 4.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.957 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.902 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 2.0 t -135.64 130.89 35.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.813 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.56 ' CE2' ' HB ' ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.52 145.61 30.22 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.0 p -123.56 121.19 35.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.944 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.874 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.75 152.43 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 111.915 -178.532 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.6 p -127.43 137.31 58.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.68 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.749 ' CG1' HD13 ' A' ' 45' ' ' LEU . 15.7 m -110.78 104.65 17.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -90.66 106.33 18.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.748 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -96.83 145.45 25.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.026 0.441 . . . . 0.0 111.535 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HA ' HD21 ' A' ' 29' ' ' LEU . 2.7 mmt180 -146.85 35.29 0.93 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.268 179.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.1 mt -101.12 -54.44 6.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.357 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.0 ptmt -153.62 -96.69 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.096 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -137.43 50.36 1.97 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.079 0.466 . . . . 0.0 109.905 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.484 ' O ' ' HB3' ' A' ' 20' ' ' TYR . . . 113.82 -66.4 0.27 Allowed Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.197 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.484 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 53.8 t80 79.98 -20.28 0.39 Allowed 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 122.544 0.338 . . . . 0.0 111.642 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.482 ' HD2' HD11 ' A' ' 51' ' ' LEU . 0.0 OUTLIER 165.16 167.9 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.921 0.391 . . . . 0.0 111.28 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.416 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 2.0 ttt180 173.19 -80.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.2 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.37 17.36 23.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.71 26.56 5.27 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.732 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.4 153.68 11.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.613 0.244 . . . . 0.0 110.373 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.31 100.08 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 110.637 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' O ' ' CG ' ' A' ' 28' ' ' HIS . 2.7 t80 -55.65 -107.55 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.056 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.531 ' CG ' ' O ' ' A' ' 27' ' ' PHE . 96.8 m-70 -163.73 170.0 17.62 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.894 0.378 . . . . 0.0 110.722 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -91.3 107.03 18.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.429 179.075 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 166.06 -142.45 7.67 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.19 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.434 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -143.35 131.5 21.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.893 0.377 . . . . 0.0 111.329 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.503 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 2.3 t-20 -124.06 138.27 54.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.08 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.07 145.05 26.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.361 0.601 . . . . 0.0 111.511 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.959 HD22 ' H ' ' A' ' 35' ' ' ALA . 1.6 tm? -101.29 150.91 22.5 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.643 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.959 ' H ' HD22 ' A' ' 34' ' ' LEU . . . -70.73 156.64 39.25 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 121.742 0.782 . . . . 0.0 112.828 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.902 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.18 105.02 3.26 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.924 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.703 ' O ' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -123.46 -170.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.955 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.613 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.8 p -85.66 43.01 1.0 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.809 ' OE1' HD23 ' A' ' 42' ' ' LEU . 0.0 OUTLIER 79.23 -16.51 0.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.069 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -44.85 -34.15 2.23 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.125 0.488 . . . . 0.0 110.586 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.582 ' OE1' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -56.99 -44.24 82.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.258 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.809 HD23 ' OE1' ' A' ' 39' ' ' GLU . 13.9 tp -56.46 -55.63 31.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.147 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -26.18 55.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.557 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -49.4 75.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.821 0.343 . . . . 0.0 110.594 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.77 HD12 HG11 ' A' ' 10' ' ' VAL . 11.4 mt -79.06 -46.55 17.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.545 ' CA ' HG11 ' A' ' 53' ' ' VAL . 1.7 tttp -54.93 -22.56 15.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.346 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.01 -70.77 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.639 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -64.07 117.2 33.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.858 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -80.57 87.27 1.53 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.509 2.14 . . . . 0.0 112.546 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.436 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 1.1 tpt180 -168.15 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.917 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.627 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -93.87 174.85 6.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.505 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -115.91 106.86 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.279 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.545 HG11 ' CA ' ' A' ' 46' ' ' LYS . 2.1 p -99.02 115.71 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.54 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.656 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.8 tp60 -108.77 130.36 55.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.823 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.874 HG22 HG23 ' A' ' 10' ' ' VAL . 1.3 pp -107.64 105.48 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.721 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.94 104.63 9.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.761 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.474 ' HB2' ' CE2' ' A' ' 8' ' ' PHE . 2.3 tm-20 -128.12 64.67 1.39 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.904 0.383 . . . . 0.0 111.032 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.8 t -154.85 39.14 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -129.31 178.56 17.28 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.512 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.2 t -107.27 -19.89 13.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.722 0.296 . . . . 0.0 111.171 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 67.44 94.86 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.89 0.376 . . . . 0.0 110.895 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -96.28 41.66 1.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.895 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 163.92 124.6 0.72 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.518 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.33 -74.85 0.34 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.458 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 60.91 100.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.831 0.348 . . . . 0.0 110.879 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 160.97 127.05 0.86 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.552 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.87 130.87 47.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.83 0.348 . . . . 0.0 110.828 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.1 t -119.09 -37.95 3.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.052 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.83 161.94 0.13 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.839 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 4.4 mm-40 -91.38 140.48 25.54 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.971 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 70' ' ' GLU . 41.1 Cg_exo -56.68 -163.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.466 2.111 . . . . 0.0 112.337 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 58.79 -177.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.121 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 147.31 59.74 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.525 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.4 m -126.33 -177.66 4.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.828 0.347 . . . . 0.0 110.878 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -94.74 -65.63 0.97 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.948 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -90.55 116.4 28.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.867 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -164.7 100.44 0.79 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.933 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -176.13 -45.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.89 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -132.58 121.81 23.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.577 ' O ' HD12 ' A' ' 80' ' ' LEU . 1.4 pp -153.63 129.19 9.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.911 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -162.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.689 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -122.45 -39.59 2.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.325 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.507 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 5.1 m-20 -81.03 -68.93 0.2 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.33 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.507 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 7.9 Cg_exo -40.45 -48.5 4.22 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.693 2.262 . . . . 0.0 112.745 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.456 ' HD3' ' CG ' ' A' ' 84' ' ' PRO . 21.8 Cg_exo -64.93 159.66 45.04 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.399 2.066 . . . . 0.0 112.142 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 54.77 79.04 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.013 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 75.3 p -85.88 -78.1 0.28 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.846 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.46 -54.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.674 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.905 HD21 HG12 ' A' ' 118' ' ' ILE . 18.9 tp -79.01 -25.65 43.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.015 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -49.04 -47.6 44.55 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.532 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.08 -13.06 22.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.691 ' HB2' HD12 ' A' ' 89' ' ' LEU . 42.9 m-85 -94.66 -20.9 19.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 120.644 0.259 . . . . 0.0 111.18 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.772 ' O ' HD21 ' A' ' 97' ' ' LEU . 1.6 p 61.13 -147.92 0.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.953 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.684 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.5 t -120.34 -54.92 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.073 0 CA-C-O 121.012 0.434 . . . . 0.0 111.512 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -65.08 -19.96 66.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.971 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.7 OUTLIER -76.33 -37.88 56.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 120.774 0.321 . . . . 0.0 110.784 -178.921 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 1.006 HD11 HD12 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -64.04 -58.5 6.49 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.766 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HD2' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -54.23 -35.07 62.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.976 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.03 -23.66 28.51 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.43 ' O ' ' N ' ' A' ' 104' ' ' ARG . 6.2 mm-40 -86.78 -39.96 15.44 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.666 HD13 HG21 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -55.94 -48.78 75.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.194 0.521 . . . . 0.0 109.945 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.553 HG23 ' CD1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -64.03 -40.59 96.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.422 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -80.38 -6.35 57.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.433 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.495 ' HB3' HD13 ' A' ' 106' ' ' ILE . 5.0 ttt180 -97.87 -15.45 20.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.307 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 108.62 15.08 14.15 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.274 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.666 HG21 HD13 ' A' ' 101' ' ' LEU . 2.8 mp -96.3 -30.88 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.111 0.456 . . . . 0.0 110.758 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.7 p 47.29 28.54 1.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.614 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.553 ' CD1' HG23 ' A' ' 102' ' ' THR . 1.1 m-85 60.62 -174.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.525 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.47 ' N ' ' HB3' ' A' ' 112' ' ' ALA . 4.9 mmtp -177.46 173.82 1.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.889 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -31.06 60.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.82 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.32 -29.94 14.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.643 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.47 ' HB3' ' N ' ' A' ' 109' ' ' LYS . . . -80.99 58.82 3.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.06 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -70.69 -66.51 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.445 ' HA ' HD21 ' A' ' 117' ' ' LEU . 10.4 ptpp? -159.0 -45.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.61 -21.64 59.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.912 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 64.1 mm-40 -85.16 -37.52 20.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.997 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.91 HD12 ' N ' ' A' ' 118' ' ' ILE . 4.0 pp -71.23 -38.03 71.98 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.001 0.429 . . . . 0.0 110.382 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 1.006 HD12 HD11 ' A' ' 97' ' ' LEU . 1.7 tt -70.03 -26.56 30.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.121 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.92 -33.47 19.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.077 0.465 . . . . 0.0 111.173 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.16 -36.0 82.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.839 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 5.8 m-85 -63.95 82.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.913 0.387 . . . . 0.0 111.277 -179.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -134.19 154.07 79.85 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.904 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.05 73.85 0.35 Allowed 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.51 2.14 . . . . 0.0 112.307 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -133.65 -46.58 0.81 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.155 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -64.47 166.36 8.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.946 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -76.27 -47.78 10.37 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.52 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -62.39 147.45 48.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.83 0.348 . . . . 0.0 110.807 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.45 157.0 17.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.85 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.25 109.04 2.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.877 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -76.51 -41.56 46.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.147 -179.994 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.6 p -178.21 108.36 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.76 0.314 . . . . 0.0 110.785 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -156.95 89.25 1.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.154 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 5.0 mtm -72.86 -74.46 0.17 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.468 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.66 176.57 8.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.16 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -177.37 109.91 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.789 0.328 . . . . 0.0 111.715 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.744 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 6.4 t -153.0 129.34 10.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.261 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.524 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.87 153.66 39.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.546 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 18.6 p -92.38 124.86 36.74 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.655 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 154.25 11.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.044 0.449 . . . . 0.0 111.334 -178.591 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.796 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.26 128.56 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 121.095 0.474 . . . . 0.0 112.035 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.017 HG13 HD13 ' A' ' 45' ' ' LEU . 1.7 m -96.92 104.53 15.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.773 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -107.96 106.58 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.621 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.695 ' HB3' HD23 ' A' ' 29' ' ' LEU . 1.3 m120 -136.8 146.6 45.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.938 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -134.03 87.83 2.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.702 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.5 mt -128.56 -59.19 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.481 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.41 6.31 1.89 Allowed 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 50.57 26.52 2.46 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.928 0.394 . . . . 0.0 110.931 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 176.2 67.77 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.902 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.421 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.3 t80 -103.63 28.53 6.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 -179.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' O ' ' CD1' ' A' ' 27' ' ' PHE . 6.9 mmt85 59.08 176.29 0.07 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.482 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.702 ' NH2' HD23 ' A' ' 45' ' ' LEU . 3.3 tpt180 -177.83 -89.31 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.723 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.78 -34.39 18.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.238 0.542 . . . . 0.0 110.516 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 160.14 41.43 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.116 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.438 ' CE1' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -166.49 169.22 14.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.575 -0.312 . . . . 0.0 110.53 -179.091 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.93 64.23 4.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.651 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.438 ' HB3' ' CE1' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -52.82 127.75 24.48 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.736 -179.919 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -70.8 108.77 4.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.896 0.379 . . . . 0.0 110.483 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.695 HD23 ' HB3' ' A' ' 14' ' ' ASN . 7.5 mp -46.95 -29.25 1.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.153 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -45.35 169.26 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.752 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -54.67 119.22 5.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.186 0.517 . . . . 0.0 111.997 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.796 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 t-20 -122.05 127.89 50.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.473 -0.785 . . . . 0.0 108.926 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 p -86.43 145.46 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.718 0.771 . . . . 0.0 112.653 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.915 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -122.09 141.33 51.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.149 179.852 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.915 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -71.16 155.92 40.18 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.141 0.496 . . . . 0.0 110.923 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.744 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.13 109.88 5.47 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.418 0.627 . . . . 0.0 111.838 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 38' ' ' SER . 0.7 OUTLIER -129.13 179.42 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.809 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.65 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.6 OUTLIER -51.22 -83.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.303 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -148.02 -16.57 0.35 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.52 -47.31 5.1 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.626 ' HG3' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -52.23 -27.69 15.75 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.0 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.44 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.3 tp -81.81 -39.8 23.48 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.843 0.354 . . . . 0.0 110.846 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -83.3 -21.46 33.23 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.422 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -70.5 -49.96 42.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 110.563 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 1.017 HD13 HG13 ' A' ' 12' ' ' VAL . 35.5 mt -78.79 -36.64 42.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.947 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.555 ' N ' HG11 ' A' ' 53' ' ' VAL . 7.4 tttm -67.37 -28.57 68.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.863 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -48.79 -28.3 3.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.228 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -101.97 104.41 35.75 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.761 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.78 66.43 4.86 Favored 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.486 2.124 . . . . 0.0 112.246 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.548 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -145.48 -39.1 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.309 -179.753 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.732 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -102.83 -167.29 1.37 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.669 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.13 106.75 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.908 0.385 . . . . 0.0 111.883 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.555 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.6 p -103.21 111.74 34.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.12 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.641 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.27 144.85 50.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.528 -179.034 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.655 HG22 HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -103.9 128.56 57.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.181 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 62.4 p -122.43 104.63 9.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.772 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -94.89 78.66 3.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.789 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -112.23 -179.85 3.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.955 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 147.45 -138.95 7.51 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.369 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 m -86.7 154.7 20.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.774 0.321 . . . . 0.0 110.884 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -69.88 78.4 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.933 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -80.15 147.12 31.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.964 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 83.06 -151.56 28.79 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.488 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.49 -65.09 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.485 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -123.38 120.38 32.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.882 0.372 . . . . 0.0 110.926 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 153.02 -75.24 0.24 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.42 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 mp -81.69 122.0 27.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.797 0.332 . . . . 0.0 110.842 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 t -157.19 136.88 12.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.956 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt 60.65 102.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.928 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.634 ' HB2' ' HD3' ' A' ' 71' ' ' PRO . 17.4 mt-10 -156.01 -53.16 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.479 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.634 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 32.0 Cg_exo -62.16 176.94 1.27 Allowed 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.171 1.914 . . . . 0.0 112.241 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 61.03 30.63 19.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.12 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -84.51 92.22 1.71 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.486 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 p -175.98 -44.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.821 0.344 . . . . 0.0 110.818 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -110.62 -32.48 6.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -76.67 -55.13 5.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.88 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -59.84 -50.77 72.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.914 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -84.04 137.84 33.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.776 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -132.41 154.5 49.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.947 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.52 -53.09 4.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.869 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.65 49.89 9.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.863 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -154.65 -68.43 0.13 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.202 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.465 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 1.0 OUTLIER -70.28 -65.28 1.11 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.113 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.465 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 2.4 Cg_endo -43.26 -57.84 1.61 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.705 2.27 . . . . 0.0 112.715 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.461 ' HD3' ' HG2' ' A' ' 84' ' ' PRO . 60.3 Cg_endo -71.92 -167.92 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.39 2.06 . . . . 0.0 112.372 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.22 161.15 14.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.802 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -138.79 126.46 22.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.923 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 60.28 176.65 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.938 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.7 tp 70.07 -56.75 0.58 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.421 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -49.05 -49.49 41.1 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.801 0.334 . . . . 0.0 111.256 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -13.87 32.61 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HB3' ' CD1' ' A' ' 118' ' ' ILE . 2.5 m-85 -79.23 139.31 37.95 Favored 'General case' 0 C--O 1.231 0.127 0 O-C-N 122.196 -0.315 . . . . 0.0 110.604 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -127.93 -70.21 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.221 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.572 ' HA ' HD11 ' A' ' 97' ' ' LEU . 39.9 t -153.27 -44.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.004 0.431 . . . . 0.0 111.405 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -20.69 38.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.642 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -76.1 -45.01 36.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 -179.334 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.835 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -59.32 -59.61 5.18 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.396 0.617 . . . . 0.0 110.27 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.491 ' HE3' HD21 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -58.29 -30.74 66.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.02 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.66 -21.4 30.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.598 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.452 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 0.0 OUTLIER -85.0 -37.55 20.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.579 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.572 ' HG ' ' CZ ' ' A' ' 121' ' ' PHE . 5.0 mt -64.57 -45.49 86.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 109.573 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.401 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.6 OUTLIER -63.59 -40.34 96.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.857 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -77.31 -6.73 54.31 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.249 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -102.01 -15.22 16.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.024 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 77.91 61.42 2.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.376 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 106' ' ' ILE . 6.3 tt -151.66 93.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.785 0.326 . . . . 0.0 111.142 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.01 140.93 6.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.068 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.571 ' N ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -121.9 -86.41 0.65 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.779 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 51.84 103.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.802 0.334 . . . . 0.0 111.346 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 64.04 178.22 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.411 . . . . 0.0 111.009 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . 0.533 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 2.4 m 56.46 23.01 7.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.037 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 111' ' ' SER . . . 168.14 75.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.04 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.75 -81.55 0.05 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.731 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.727 ' O ' HG22 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -131.88 -57.47 0.98 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.589 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.57 74.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 0.0 110.737 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -86.18 -33.54 20.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.359 0.599 . . . . 0.0 110.369 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.638 ' CD2' HD13 ' A' ' 97' ' ' LEU . 7.8 tp -78.09 -21.54 50.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.994 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.835 ' HA ' HD22 ' A' ' 97' ' ' LEU . 2.4 tp -82.77 -29.66 8.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.55 -31.02 21.46 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.71 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 tp -49.23 -45.1 44.1 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.07 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CZ ' ' HG ' ' A' ' 101' ' ' LEU . 48.8 m-85 -62.63 81.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.368 . . . . 0.0 110.953 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -120.84 102.99 43.75 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.129 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -49.86 -25.8 12.63 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.434 2.089 . . . . 0.0 112.382 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -56.55 154.75 8.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -94.99 152.61 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.996 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -132.36 -99.92 0.76 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.46 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -142.59 -168.37 2.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 110.988 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.91 113.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.957 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 28.7 t -154.28 -48.06 0.09 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -110.16 163.17 13.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.102 179.975 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.519 -0.232 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.3 134.64 33.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.764 0.316 . . . . 0.0 110.984 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -121.81 -172.1 2.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.7 mtt -75.36 -77.09 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.88 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -94.68 157.27 16.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.821 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -148.01 134.27 19.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.967 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.895 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -117.17 140.49 49.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.659 179.947 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.06 145.24 31.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.322 0.582 . . . . 0.0 112.535 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 14.5 p -92.75 126.52 37.87 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.95 153.59 11.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.459 -178.503 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.1 p -138.51 126.9 29.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 0.0 111.623 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.77 HG13 HD13 ' A' ' 45' ' ' LEU . 7.7 m -95.74 104.44 15.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.289 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -99.52 106.56 18.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.614 ' OD1' HD12 ' A' ' 16' ' ' ILE . 1.8 t30 -126.41 135.9 51.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.815 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.79 16.89 15.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.951 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.674 HG22 ' N ' ' A' ' 17' ' ' LYS . 1.5 mt -59.9 -70.55 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.843 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.674 ' N ' HG22 ' A' ' 16' ' ' ILE . 7.7 pttm -167.0 -173.77 2.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.902 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.447 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 15.8 pt-20 -96.0 -14.3 23.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.686 0.279 . . . . 0.0 111.526 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -105.57 54.6 0.59 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.422 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.589 ' CD2' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -117.25 13.33 14.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.758 0.313 . . . . 0.0 111.565 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 60.69 -175.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.33 0.586 . . . . 0.0 112.123 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.449 ' CD ' ' HB2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -173.53 -161.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.058 179.444 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -48.94 -26.81 2.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.014 0.435 . . . . 0.0 110.942 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 146.23 37.07 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.225 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.479 ' N ' ' CD1' ' A' ' 25' ' ' PHE . 0.9 OUTLIER -142.07 26.04 1.88 Allowed 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.38 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 42.1 53.93 4.2 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.905 0.383 . . . . 0.0 111.425 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.449 ' HB2' ' CD ' ' A' ' 22' ' ' ARG . 3.5 t80 -57.24 153.22 12.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.998 -179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 18' ' ' GLU . 9.6 m170 -103.15 172.61 6.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.12 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.437 ' H ' HD23 ' A' ' 29' ' ' LEU . 0.5 OUTLIER -63.8 74.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.888 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 28' ' ' HIS . . . -144.0 -143.47 4.07 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.425 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.463 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 3.5 p-10 -137.1 132.18 33.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.919 0.39 . . . . 0.0 111.454 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.503 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 13.6 t-20 -122.24 133.83 54.7 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.054 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.6 m -87.1 145.42 26.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 111.63 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.914 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.84 142.18 44.53 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.998 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.914 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.4 157.58 37.53 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.33 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.23 113.05 6.22 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.688 0.756 . . . . 0.0 111.155 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.611 HG12 ' H ' ' A' ' 38' ' ' SER . 2.8 t -129.28 171.71 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.708 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.611 ' H ' HG12 ' A' ' 37' ' ' VAL . 42.7 m -56.38 -72.55 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.16 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.5 -16.67 0.11 Allowed 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 p -46.21 -41.09 12.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.72 -28.56 63.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 46' ' ' LYS . 10.6 tp -78.45 -50.59 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.0 110.8 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.53 -22.35 59.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.496 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -66.85 -44.56 80.71 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.934 0.397 . . . . 0.0 110.371 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.851 HD12 HG23 ' A' ' 53' ' ' VAL . 18.0 mt -78.88 -54.08 6.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.379 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 2.5 mttp -45.59 -28.75 1.02 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.469 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.82 -27.51 5.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.305 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.57 94.13 48.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.5 -21.27 18.08 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.733 2.289 . . . . 0.0 112.712 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.581 ' C ' HD13 ' A' ' 51' ' ' LEU . 9.1 ttm180 -47.65 -39.7 17.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.49 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.754 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -107.28 -165.22 1.04 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.519 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.59 140.75 48.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.747 0.308 . . . . 0.0 111.514 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.851 HG23 HD12 ' A' ' 45' ' ' LEU . 3.3 p -132.22 116.81 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.896 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.529 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.5 mt-30 -127.63 133.19 49.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.653 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.477 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -93.93 130.67 42.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.966 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.0 p -122.36 104.67 9.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.785 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -156.11 -72.68 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.005 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.0 p 55.95 171.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.961 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 166.44 50.14 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.584 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.0 p -115.13 -59.76 1.97 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.346 . . . . 0.0 110.971 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.75 165.04 11.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.81 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -131.54 90.38 2.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.823 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 123.37 -58.4 0.63 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.45 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -110.11 166.21 12.43 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.482 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -97.91 136.43 38.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.797 0.332 . . . . 0.0 110.898 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -83.74 110.78 3.35 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.466 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -78.12 -71.5 0.42 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.896 0.379 . . . . 0.0 110.968 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 59.8 p -115.89 174.89 5.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.947 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -112.23 -60.26 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.793 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 62.42 84.48 0.19 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.031 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 39.4 Cg_exo -60.61 -16.3 42.11 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.668 2.245 . . . . 0.0 112.498 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.542 ' HB3' ' O ' ' A' ' 71' ' ' PRO . . . 75.56 91.06 0.08 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.076 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -142.29 -148.26 4.96 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.496 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.62 145.44 0.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 59.25 -177.59 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.912 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 0.0 OUTLIER 74.09 -60.84 0.51 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.086 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 76' ' ' GLU . 1.5 pm0 39.69 65.46 0.71 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.781 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.6 mtpp 61.95 -178.38 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.001 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 63.16 98.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.939 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 mp -98.14 -63.81 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 -149.35 102.15 3.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.848 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 61.19 76.89 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.054 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -141.23 105.17 6.06 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -68.45 111.12 2.44 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.342 2.028 . . . . 0.0 112.272 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.76 117.33 4.8 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.368 2.045 . . . . 0.0 112.289 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.2 m -73.12 -30.5 63.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.978 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.2 p -96.15 153.74 17.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -176.67 -40.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.945 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 118' ' ' ILE . 4.2 mm? -82.04 -40.68 21.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.941 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -48.74 -35.87 15.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.698 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -62.23 -12.59 21.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.552 ' HB3' HD23 ' A' ' 97' ' ' LEU . 8.0 m-85 -80.73 -8.04 59.54 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.256 -0.278 . . . . 0.0 111.346 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.87 -162.17 0.19 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.779 0.323 . . . . 0.0 111.079 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.597 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.9 t -115.78 -42.72 3.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.21 0.529 . . . . 0.0 110.947 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -78.21 -19.71 53.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.121 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -27.53 54.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.0 110.675 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.757 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -76.35 -59.08 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.506 ' CE ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -47.38 -34.93 7.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.741 177.711 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.94 -21.71 29.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.021 0.439 . . . . 0.0 111.737 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.438 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 4.1 mm-40 -86.65 -38.59 16.91 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.566 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.611 HD23 ' CZ ' ' A' ' 121' ' ' PHE . 3.2 mt -59.84 -48.07 83.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.118 0.485 . . . . 0.0 109.964 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.568 HG23 ' CE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -65.44 -39.03 91.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -6.57 58.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.3 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.494 ' HD3' HD11 ' A' ' 106' ' ' ILE . 2.1 ttt85 -100.12 -15.57 18.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.308 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 98.72 38.9 3.77 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.339 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.494 HD11 ' HD3' ' A' ' 104' ' ' ARG . 4.2 mp -110.32 -22.01 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.793 0.296 . . . . 0.0 111.045 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 106' ' ' ILE . 14.7 t 45.51 28.34 0.49 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.794 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.568 ' CE1' HG23 ' A' ' 102' ' ' THR . 90.2 m-85 51.24 -160.23 0.09 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.108 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.8 pttt 45.52 93.13 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.064 0.459 . . . . 0.0 111.322 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 179.0 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.618 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 179.18 42.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.765 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.713 ' HB1' ' HB2' ' A' ' 117' ' ' LEU . . . -145.22 147.67 32.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.201 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.419 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 52.5 p -139.72 -80.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.4 tttm -145.38 -57.12 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.74 0.305 . . . . 0.0 110.74 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.0 -22.18 33.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.088 0.471 . . . . 0.0 109.884 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -86.2 -38.22 17.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 179.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.713 ' HB2' ' HB1' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -74.5 -36.82 63.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.181 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.849 ' O ' HD13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -62.67 -28.54 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.402 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.27 -33.0 19.41 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.918 0.39 . . . . 0.0 111.559 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.3 OUTLIER -59.43 -53.02 62.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.305 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.611 ' CZ ' HD23 ' A' ' 101' ' ' LEU . 24.8 m-85 -43.55 90.55 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.939 0.399 . . . . 0.0 111.75 -178.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -174.98 115.25 0.29 Allowed Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.149 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.24 61.13 2.57 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.414 2.076 . . . . 0.0 112.254 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -179.62 175.9 0.84 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.964 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -177.62 173.87 1.59 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.893 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -142.9 -171.37 13.37 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -89.35 -26.76 20.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.739 0.304 . . . . 0.0 111.043 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.31 169.76 0.57 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.002 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.34 -65.37 1.02 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.891 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.89 163.02 28.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.87 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.102 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -86.52 125.61 33.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.812 0.339 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -99.14 -26.58 14.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.977 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 mmm 65.06 114.33 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.854 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.75 90.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -136.38 29.79 2.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.757 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 8.0 t -104.31 130.02 52.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.586 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -146.92 148.06 31.4 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.9 m -96.18 115.01 26.76 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.839 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -110.17 151.39 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-O 120.895 0.378 . . . . 0.0 111.59 -178.711 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.743 HG23 ' C ' ' A' ' 32' ' ' ASN . 7.6 p -137.4 131.7 44.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.538 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.849 HG13 HD13 ' A' ' 45' ' ' LEU . 29.3 m -93.06 104.75 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.287 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.402 ' HA ' ' HB3' ' A' ' 31' ' ' ASP . 0.6 OUTLIER -86.53 106.68 17.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.705 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.649 ' CG ' HD12 ' A' ' 51' ' ' LEU . 6.8 t30 -108.16 112.73 25.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.38 43.42 1.12 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.165 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.892 HG22 ' HG2' ' A' ' 17' ' ' LYS . 3.2 mp -106.38 -61.5 2.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.385 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.892 ' HG2' HG22 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -176.51 -170.73 0.36 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.765 0.317 . . . . 0.0 111.094 -179.898 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.417 ' HA ' ' N ' ' A' ' 29' ' ' LEU . 5.4 mm-40 -84.24 -7.78 59.24 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.655 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -136.18 80.38 0.3 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.81 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.522 ' CD1' HG21 ' A' ' 16' ' ' ILE . 3.4 t80 -130.48 23.94 5.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.82 0.343 . . . . 0.0 111.053 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 60.24 171.63 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.159 0.504 . . . . 0.0 111.492 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.48 ' CB ' ' HB2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -179.05 -84.62 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.29 178.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -101.69 15.88 27.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.936 0.398 . . . . 0.0 110.092 178.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.78 37.61 7.29 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.978 -0.629 . . . . 0.0 111.868 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -155.65 36.07 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 45.78 95.93 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.795 0.331 . . . . 0.0 111.464 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.48 ' HB2' ' CB ' ' A' ' 22' ' ' ARG . 10.9 t80 -77.42 138.98 39.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.049 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -70.09 176.51 3.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.769 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.573 HD13 ' C ' ' A' ' 29' ' ' LEU . 3.5 tm? -82.33 103.0 11.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.11 0.481 . . . . 0.0 110.644 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.27 -142.38 7.91 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.705 -0.679 . . . . 0.0 112.288 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.53 ' HB2' HG22 ' A' ' 11' ' ' VAL . 34.1 p-10 -138.44 139.16 38.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.963 0.411 . . . . 0.0 111.173 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.743 ' C ' HG23 ' A' ' 11' ' ' VAL . 2.0 t-20 -113.88 125.08 53.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.061 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.0 145.43 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.434 0.635 . . . . 0.0 111.685 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.939 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -112.09 138.95 48.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.816 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.939 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.45 156.68 39.04 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.279 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.757 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.46 108.4 4.26 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 111.426 -178.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.679 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -128.21 -176.51 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.186 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.679 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -48.82 -68.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.472 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.16 -17.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.5 t -42.42 -37.66 1.65 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.793 0.33 . . . . 0.0 111.687 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.686 ' HG2' HD11 ' A' ' 34' ' ' LEU . 2.3 pp0? -53.62 -50.46 65.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.456 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.683 HD13 ' CG2' ' A' ' 55' ' ' ILE . 5.7 tp -58.32 -46.47 86.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.091 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.87 -33.09 68.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.301 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -44.31 93.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.943 0.402 . . . . 0.0 110.279 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.849 HD13 HG13 ' A' ' 12' ' ' VAL . 21.9 mt -78.74 -33.63 46.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.885 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.4 mttt -71.17 -22.58 62.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.132 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.09 -61.83 1.7 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.574 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.03 124.51 53.94 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.69 56.89 6.24 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.576 2.184 . . . . 0.0 112.418 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.563 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -111.69 -39.36 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.944 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.688 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -111.86 -173.1 2.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.446 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 52' ' ' VAL . 16.2 m -119.44 106.26 18.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.835 0.35 . . . . 0.0 111.881 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.469 HG23 HD12 ' A' ' 45' ' ' LEU . 2.5 p -99.87 106.19 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.172 0.51 . . . . 0.0 110.757 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.455 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -127.33 127.89 45.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.107 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.839 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.13 130.35 37.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.05 0.452 . . . . 0.0 111.455 -179.824 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.9 p -122.32 104.64 9.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.559 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -105.12 -60.48 1.61 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.018 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 t -129.17 -46.06 1.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.918 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 172.54 168.4 33.86 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.456 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.9 p -103.98 142.75 33.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.813 0.34 . . . . 0.0 110.982 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.84 175.68 9.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.914 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 60.36 29.76 19.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.875 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -93.63 -23.4 23.73 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.574 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 179.51 -35.85 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.531 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -91.02 50.41 1.78 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.849 0.357 . . . . 0.0 110.925 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.445 ' H ' HD23 ' A' ' 67' ' ' LEU . . . -164.83 84.42 0.1 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.511 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.445 HD23 ' H ' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -168.23 -177.38 3.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.825 0.345 . . . . 0.0 110.933 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.0 m -146.43 -48.11 0.2 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.895 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -101.24 129.86 47.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.867 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -154.7 157.1 32.04 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.883 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.56 -168.14 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.582 2.188 . . . . 0.0 112.309 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.07 80.64 3.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.073 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -103.98 108.23 3.14 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.548 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.26 126.63 24.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.925 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 60.22 32.03 20.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.89 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.86 85.67 2.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.799 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.75 8.61 30.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.311 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 mttt 61.91 -81.07 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.745 0.307 . . . . 0.0 111.002 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.38 138.95 50.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.863 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.54 -48.5 1.93 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -158.66 146.27 17.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.851 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -101.3 126.66 48.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.1 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.457 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 0.3 OUTLIER -168.22 -65.01 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.939 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 2.5 Cg_endo -42.63 -57.71 1.56 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.806 2.338 . . . . 0.0 112.628 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.436 ' HD3' ' HG2' ' A' ' 84' ' ' PRO . 55.7 Cg_endo -69.62 143.93 53.1 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.376 2.051 . . . . 0.0 112.316 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -171.34 -67.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.919 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.9 p -71.89 -178.04 2.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 67.42 -69.98 0.13 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.035 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.5 HD11 ' O ' ' A' ' 118' ' ' ILE . 1.7 mm? -64.18 -15.92 60.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.386 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -48.62 -49.44 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.7 0.286 . . . . 0.0 111.221 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -10.1 10.3 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 3.7 m-85 -104.9 127.45 52.73 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.691 0.281 . . . . 0.0 110.655 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.499 ' O ' HG21 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -116.3 -87.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.06 -179.729 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.789 ' HA ' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -151.83 -37.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-O 120.972 0.415 . . . . 0.0 111.047 179.855 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.63 -19.66 35.05 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.869 0.366 . . . . 0.0 110.99 178.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -77.91 -43.1 31.03 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.246 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.966 HD23 HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -64.8 -55.84 17.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.868 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.465 ' CD ' ' O ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -50.89 -31.95 19.08 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.0 178.785 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.06 -25.26 27.71 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.122 0.487 . . . . 0.0 111.537 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 1.7 mt-30 -86.88 -43.59 12.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.888 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.776 HD22 HG21 ' A' ' 106' ' ' ILE . 8.8 mt -54.74 -46.75 74.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.465 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -39.07 88.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.855 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -15.85 63.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.652 ' HD3' HD23 ' A' ' 101' ' ' LEU . 8.7 ptm180 -107.96 -15.23 14.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.047 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.59 83.9 0.47 Allowed Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.826 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.776 HG21 HD22 ' A' ' 101' ' ' LEU . 14.6 tt -125.84 -39.46 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.69 0.281 . . . . 0.0 111.524 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.1 m 71.58 87.8 0.11 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.647 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -116.0 124.89 51.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.997 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -176.98 37.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -170.8 30.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.341 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 84.2 p 178.78 -76.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.749 0.309 . . . . 0.0 110.922 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 117' ' ' LEU . . . -64.08 81.02 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.734 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -72.4 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.364 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.776 ' O ' HG23 ' A' ' 118' ' ' ILE . 0.3 OUTLIER -146.05 -57.44 0.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.491 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.28 67.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 11.8 mm-40 -85.91 -37.1 19.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.886 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.966 HD21 HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -69.15 -40.85 77.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.828 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.776 HG23 ' O ' ' A' ' 114' ' ' LYS . 0.9 OUTLIER -70.6 -30.5 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.476 ' N ' HG13 ' A' ' 118' ' ' ILE . . . -86.16 -31.83 21.6 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.34 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 1.1 mp -54.52 -42.75 71.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.323 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.511 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 1.9 m-85 -46.04 -28.09 1.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.601 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.48 ' HB2' HD21 ' A' ' 89' ' ' LEU . . . -47.34 131.37 9.98 Favored Pre-proline 0 CA--C 1.531 0.238 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.23 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -51.57 -41.77 59.19 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.448 2.099 . . . . 0.0 112.391 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -161.05 147.23 14.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -129.25 35.01 4.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -157.15 -44.12 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.513 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -135.47 126.45 27.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.844 0.354 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -176.33 151.14 0.97 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.873 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 60.29 -178.44 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.926 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -135.59 -47.25 0.68 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.922 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.148 -0.929 . . . . 0.0 111.146 179.905 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 t -91.57 163.24 14.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.819 0.342 . . . . 0.0 110.994 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 61.3 114.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.2 mtt -155.33 160.33 40.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -60.7 93.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.867 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -113.05 -29.79 7.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.038 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.776 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 12.5 t -138.57 130.7 28.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.962 0.41 . . . . 0.0 111.072 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -146.79 145.28 29.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.24 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.6 p -94.45 133.4 38.08 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.762 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.43 155.86 11.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 121.039 0.447 . . . . 0.0 111.569 -179.093 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.3 p -138.34 101.53 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.596 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.719 HG21 HD22 ' A' ' 45' ' ' LEU . 36.2 t -92.69 129.23 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.161 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.81 107.41 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.433 ' HB3' ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -128.22 144.22 51.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.909 0.385 . . . . 0.0 110.753 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -120.57 81.58 1.78 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.198 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.3 mt -129.65 -58.01 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.171 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.23 -18.07 0.91 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.715 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 65.63 23.13 11.67 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.138 0.494 . . . . 0.0 110.318 -179.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -178.07 57.61 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.497 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.531 ' HB2' HD11 ' A' ' 29' ' ' LEU . 1.1 t80 -91.09 30.97 1.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.892 0.377 . . . . 0.0 111.352 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.02 -173.29 0.12 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.186 0.517 . . . . 0.0 111.817 178.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.5 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 14.9 tpp180 -178.61 -33.73 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.927 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 22' ' ' ARG . . . 170.69 -32.18 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.653 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 155.59 31.37 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.082 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -129.56 20.19 5.65 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.522 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 42.96 37.56 1.15 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.956 0.408 . . . . 0.0 110.93 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.446 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -45.26 96.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.643 -179.336 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -60.94 124.5 20.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.537 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 20' ' ' TYR . 17.3 mt -58.2 -32.41 68.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.116 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -55.64 -168.56 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.756 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -57.33 121.07 9.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 111.411 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 23.0 t-20 -143.64 123.66 13.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.4 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -86.85 145.58 26.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.398 0.618 . . . . 0.0 111.361 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.939 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -115.37 141.37 48.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.97 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.939 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.32 156.1 39.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.158 0.504 . . . . 0.0 110.555 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.776 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.56 105.34 3.07 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.496 0.665 . . . . 0.0 111.715 -177.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.647 HG23 ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -122.31 -175.92 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.909 -179.674 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.647 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -59.73 -63.91 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.558 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -173.43 -18.64 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.7 m -42.41 -32.1 0.49 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.991 0.424 . . . . 0.0 111.011 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.649 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.59 -61.64 2.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.548 179.268 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.467 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 7.3 tp -52.6 -52.83 53.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.71 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.591 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -66.42 -34.88 78.95 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.682 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.09 -52.52 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.909 0.385 . . . . 0.0 110.438 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.719 HD22 HG21 ' A' ' 12' ' ' VAL . 0.5 OUTLIER -78.71 -54.54 6.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.748 179.516 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.532 ' N ' HG11 ' A' ' 53' ' ' VAL . 1.3 tptt -53.47 -24.05 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.304 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.26 -29.94 1.82 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 111.372 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -128.62 125.78 23.2 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 61.28 4.96 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.405 2.07 . . . . 0.0 112.366 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.805 ' C ' HD13 ' A' ' 51' ' ' LEU . 20.8 mmt-85 -123.91 -39.69 2.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.805 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.0 OUTLIER -119.85 133.44 55.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.962 0.41 . . . . 0.0 110.971 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 12' ' ' VAL . 4.2 t -68.87 107.21 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.768 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.532 HG11 ' N ' ' A' ' 46' ' ' LYS . 2.1 p -103.4 115.26 45.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.938 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.754 ' O ' HG22 ' A' ' 10' ' ' VAL . 31.0 mt-30 -127.07 144.9 50.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.833 -0.622 . . . . 0.0 112.165 -178.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.748 HG22 HG23 ' A' ' 10' ' ' VAL . 1.9 pt -102.64 134.39 43.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.176 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.8 m -122.4 104.64 9.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -69.81 -70.57 0.28 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 67.8 p -144.42 -176.62 5.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.963 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -129.33 100.17 0.49 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.547 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.61 -27.03 58.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.784 0.326 . . . . 0.0 111.031 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -56.28 133.1 52.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.011 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 60.92 156.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -94.51 -37.58 5.27 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.503 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.87 152.22 6.36 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.539 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -174.77 39.08 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.833 0.349 . . . . 0.0 110.938 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -145.95 172.74 26.52 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.482 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.24 -41.07 6.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.749 0.309 . . . . 0.0 110.911 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 52.3 p 53.97 65.53 1.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.111 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -163.78 31.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.941 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.506 ' N ' ' HD2' ' A' ' 71' ' ' PRO . 5.0 tp10 -72.66 -50.09 7.86 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.225 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 70' ' ' GLU . 73.5 Cg_endo -74.98 136.61 20.67 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.283 1.989 . . . . 0.0 112.383 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.44 81.06 1.56 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.055 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 68.03 72.94 0.74 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.558 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.54 -59.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.808 0.337 . . . . 0.0 110.941 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.72 -42.37 67.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.912 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -70.34 -169.76 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.947 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 64.54 135.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.917 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -64.71 93.67 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.982 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -172.75 117.5 0.33 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.488 HD23 ' NH2' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -139.27 139.69 37.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.845 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.488 ' NH2' HD23 ' A' ' 80' ' ' LEU . 0.1 OUTLIER 59.59 -179.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.966 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -144.17 159.63 42.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.995 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -166.39 63.05 0.77 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.814 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.455 ' HG2' ' HD3' ' A' ' 85' ' ' PRO . 4.1 Cg_exo -39.17 -51.92 2.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.251 2.634 . . . . 0.0 112.751 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.455 ' HD3' ' HG2' ' A' ' 84' ' ' PRO . 87.9 Cg_exo -46.06 98.9 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.419 2.08 . . . . 0.0 112.425 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.4 m -59.24 -30.64 68.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.857 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.451 HG22 ' H ' ' A' ' 88' ' ' ASP . 0.2 OUTLIER -151.05 -170.49 3.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.811 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.525 ' C ' HD22 ' A' ' 89' ' ' LEU . 0.9 OUTLIER -110.66 -30.57 7.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.811 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.561 ' N ' HD22 ' A' ' 89' ' ' LEU . 3.0 mm? -117.24 -43.74 2.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.885 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.422 ' HB2' ' CB ' ' A' ' 87' ' ' THR . 1.9 m120 -48.97 -37.18 19.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.495 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 38.3 p -61.98 -15.21 42.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -94.23 133.8 37.37 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.804 0.335 . . . . 0.0 110.675 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.671 ' O ' HG13 ' A' ' 94' ' ' VAL . 3.0 p -74.45 -94.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.359 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.671 HG13 ' O ' ' A' ' 93' ' ' THR . 1.4 m -164.41 -38.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.054 0.454 . . . . 0.0 110.79 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.75 -20.88 38.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.691 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -66.95 -52.23 45.45 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.349 0.595 . . . . 0.0 109.74 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 1.044 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.92 -59.61 4.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.715 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.45 ' HE3' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -44.65 -38.35 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.939 178.431 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.19 -21.92 28.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.048 0.452 . . . . 0.0 111.669 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 6.8 mm-40 -86.37 -47.81 9.02 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.09 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.667 HD13 HG21 ' A' ' 106' ' ' ILE . 5.5 mt -51.89 -48.3 64.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.164 0.506 . . . . 0.0 109.845 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.497 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -62.12 -41.42 98.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.229 179.462 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.74 -6.96 50.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.106 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -105.81 -15.43 14.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 78.5 70.94 1.27 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.94 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.718 HG23 ' N ' ' A' ' 107' ' ' THR . 0.2 OUTLIER -128.26 -159.33 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.718 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -140.45 116.11 10.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.838 0.351 . . . . 0.0 110.791 179.88 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.497 ' CZ ' HG23 ' A' ' 102' ' ' THR . 2.4 p90 -138.72 105.85 5.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.987 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -176.78 37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.783 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.52 -50.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 91.6 p -101.05 -63.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.465 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -70.61 64.79 0.3 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.07 0.462 . . . . 0.0 110.334 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -61.19 -75.14 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.346 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.976 ' O ' HG23 ' A' ' 118' ' ' ILE . 1.5 ptmt -146.3 -57.46 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.718 0.294 . . . . 0.0 111.434 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.24 -23.01 64.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.863 0.363 . . . . 0.0 111.115 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.4 mm-40 -85.82 -36.29 20.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.855 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.765 ' HG ' HD13 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -74.48 -37.11 63.28 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.597 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 1.044 ' HA ' HD22 ' A' ' 97' ' ' LEU . 1.7 pp -64.72 -35.19 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.579 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.33 -28.26 23.79 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.891 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.789 ' O ' HD22 ' A' ' 120' ' ' LEU . 1.0 OUTLIER -65.01 -30.6 71.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.687 -179.086 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.507 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.0 OUTLIER -61.37 82.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.721 0.296 . . . . 0.0 111.151 -179.645 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -125.23 74.91 68.06 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.303 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.98 124.66 12.97 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.682 2.254 . . . . 0.0 112.106 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -153.5 117.85 4.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.167 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.85 109.4 18.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.857 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -59.28 -92.57 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.653 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -150.89 -46.38 0.12 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.765 0.316 . . . . 0.0 111.06 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -123.73 79.96 1.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.818 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 63.6 p -81.96 160.26 23.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.935 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -102.81 165.22 11.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.875 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.092 179.995 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m 60.59 80.63 0.21 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.808 0.337 . . . . 0.0 110.938 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -87.36 -59.72 2.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.893 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.1 mtt -147.04 99.95 3.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.791 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -135.34 -49.61 0.73 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -150.06 158.17 43.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.017 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.844 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -116.68 139.83 50.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.793 -179.989 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.612 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -145.22 144.09 30.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.43 0.633 . . . . 0.0 112.393 -179.522 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.4 p -95.1 121.83 37.14 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.801 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 151.53 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 111.355 -178.775 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.9 p -134.17 123.5 43.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.242 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.119 HG13 HD23 ' A' ' 45' ' ' LEU . 1.8 m -95.65 104.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.784 -179.316 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.43 106.89 19.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.896 178.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.446 ' O ' HD12 ' A' ' 29' ' ' LEU . 12.3 p-10 -96.3 117.09 30.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.24 0.543 . . . . 0.0 111.61 -179.2 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.5 28.59 4.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.184 178.244 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.719 HD13 ' CD2' ' A' ' 20' ' ' TYR . 7.3 mt -83.78 -77.77 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.268 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.547 ' N ' HG22 ' A' ' 16' ' ' ILE . 11.2 mtmt -155.26 -168.6 2.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.733 0.301 . . . . 0.0 110.844 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -102.41 28.03 6.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.556 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 176.96 58.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.288 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.719 ' CD2' HD13 ' A' ' 16' ' ' ILE . 9.4 t80 -99.66 19.52 15.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 0.0 110.921 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 62.14 174.57 0.13 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.316 0.579 . . . . 0.0 111.819 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.527 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -171.83 -79.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.862 179.001 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.96 -4.72 52.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.563 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.91 44.66 0.8 Allowed Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.972 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.492 ' O ' ' CB ' ' A' ' 26' ' ' SER . 0.8 OUTLIER -156.52 -56.03 0.09 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.454 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.492 ' CB ' ' O ' ' A' ' 25' ' ' PHE . 2.5 p 154.2 116.5 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.63 0.372 . . . . 0.0 110.179 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.527 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 38.0 t80 -87.79 -18.68 28.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.387 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 65.37 170.23 0.21 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.765 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 14' ' ' ASN . 14.1 tp -90.65 105.75 18.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.561 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 177.06 -141.4 5.35 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.357 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.484 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 2.2 p30 -150.06 136.36 18.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.679 0.276 . . . . 0.0 111.201 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.2 t30 -116.74 131.94 56.82 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.291 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.02 145.54 26.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.536 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.961 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -113.75 140.61 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.19 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.961 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.29 157.5 37.59 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.202 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.844 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.4 112.74 6.14 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.734 0.778 . . . . 0.0 111.2 -177.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.547 ' N ' HG22 ' A' ' 7' ' ' THR . 3.5 t -128.35 168.82 20.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 CA-C-N 114.463 -1.244 . . . . 0.0 110.584 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.54 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.2 m -55.3 -61.25 2.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.273 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -164.91 -16.76 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.488 ' OG ' HG11 ' A' ' 37' ' ' VAL . 3.0 p -43.62 -33.67 1.25 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.612 ' NE2' ' CE1' ' A' ' 8' ' ' PHE . 4.4 pp0? -65.79 -37.43 86.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.799 0.333 . . . . 0.0 111.749 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.529 ' HB2' ' NE2' ' A' ' 41' ' ' GLN . 5.2 tp -68.31 -38.75 81.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -86.86 -28.99 22.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.276 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -47.93 81.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.874 0.369 . . . . 0.0 110.378 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 1.119 HD23 HG13 ' A' ' 12' ' ' VAL . 1.9 mp -79.02 -41.53 28.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.46 ' N ' HG11 ' A' ' 53' ' ' VAL . 3.5 ttpt -73.27 -12.74 60.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.299 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.565 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -50.81 -33.29 22.92 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.822 0.344 . . . . 0.0 111.295 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 p-10 -121.66 129.83 25.03 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.83 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -77.09 70.82 6.52 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.5 2.134 . . . . 0.0 112.272 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.431 ' C ' HD12 ' A' ' 51' ' ' LEU . 2.0 mtt85 -131.8 -56.01 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.886 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 51' ' ' LEU . 2.8 mp -100.51 170.46 8.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.628 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.9 t -105.58 107.39 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.608 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.509 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 1.5 p -101.18 114.57 40.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.29 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.476 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.8 OUTLIER -127.12 125.93 42.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.454 -179.232 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.801 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.19 145.79 7.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.289 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 44.3 p -121.99 104.61 9.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.644 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -59.56 -76.73 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.016 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 p -108.53 111.01 22.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.977 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -115.17 27.49 8.52 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.472 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 t -108.88 -32.35 7.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.828 0.347 . . . . 0.0 110.892 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.91 97.94 2.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.88 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 61.43 92.37 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.783 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -97.3 -160.15 31.28 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.579 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -130.3 -173.92 13.53 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.454 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -105.42 -31.32 9.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.855 0.359 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 114.28 137.27 6.48 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.59 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.5 mt -148.08 40.81 0.98 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.862 0.363 . . . . 0.0 110.856 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.41 139.63 31.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.946 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -114.35 128.64 56.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.912 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.402 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 0.4 OUTLIER -87.88 -53.8 0.37 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.889 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 60.3 Cg_exo -51.43 -40.37 62.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.532 2.155 . . . . 0.0 112.237 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.71 150.21 32.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.024 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 164.63 -83.3 0.11 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.502 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 p -174.46 128.59 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.94 0.4 . . . . 0.0 110.842 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -152.18 133.82 14.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 63.32 -81.33 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.953 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.01 -174.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.028 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.0 tttt -80.35 117.88 21.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.933 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -157.13 131.96 8.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.3 mp -105.57 150.01 25.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.854 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.7 tpt85 -160.74 -69.14 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.988 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.38 113.24 3.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.076 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.413 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 2.5 m-20 -79.98 -61.61 0.44 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.066 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.413 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 73.2 Cg_endo -76.03 123.31 7.22 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.503 2.135 . . . . 0.0 112.327 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.35 -62.24 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.396 2.064 . . . . 0.0 112.234 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.1 m -133.67 102.58 5.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.784 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.8 p -138.24 60.5 1.62 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 59.8 163.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 118' ' ' ILE . 12.5 tp 75.47 -56.36 0.61 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.217 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.8 m-20 -48.78 -45.63 40.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.428 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.3 p -62.09 -14.55 37.63 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -84.09 143.82 29.46 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.684 0.278 . . . . 0.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 69.9 p -110.63 -88.23 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.588 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.617 HG13 ' HG3' ' A' ' 114' ' ' LYS . 40.6 t -154.56 -43.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -80.3 -20.84 43.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.081 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.1 -49.58 42.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 0.0 110.19 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.776 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -56.02 -58.56 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.528 179.557 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.476 ' HE2' HD11 ' A' ' 117' ' ' LEU . 4.1 ttmt -55.63 -34.67 65.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.02 -21.64 29.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.056 0.455 . . . . 0.0 111.573 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.466 ' N ' ' O ' ' A' ' 96' ' ' GLN . 3.5 mm-40 -86.53 -41.09 14.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.302 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.69 HD22 HG21 ' A' ' 106' ' ' ILE . 12.9 mt -56.14 -49.91 72.61 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.315 0.579 . . . . 0.0 109.754 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.69 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -64.11 -38.96 92.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.324 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.65 -6.84 53.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.957 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.3 mtt180 -100.36 -15.32 18.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.858 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.96 47.58 4.97 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.838 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.69 HG21 HD22 ' A' ' 101' ' ' LEU . 9.2 tt -140.43 95.91 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.822 0.344 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.03 122.94 9.33 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.951 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.69 ' HE1' HG23 ' A' ' 102' ' ' THR . 13.7 p90 -121.56 28.02 7.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.131 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -29.34 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.852 0.358 . . . . 0.0 110.77 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -124.98 150.97 46.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.855 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.15 26.34 13.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 108' ' ' PHE . . . -148.53 103.99 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.18 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.4 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 72.3 p -98.92 -79.38 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.725 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.668 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 20.4 tttt -158.4 -39.5 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.087 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.7 -20.44 33.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.028 0.442 . . . . 0.0 110.224 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -85.59 -39.08 17.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.756 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.668 ' CD2' ' HA ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -78.31 -19.55 53.31 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.153 -179.771 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.776 ' HA ' HD22 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -80.79 -28.39 11.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 120.566 -0.453 . . . . 0.0 109.974 178.156 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.428 ' HA ' HD11 ' A' ' 89' ' ' LEU . . . -87.09 -33.12 19.59 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.133 0.492 . . . . 0.0 111.106 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.5 OUTLIER -54.18 -42.76 70.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.269 -178.911 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.578 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 30.7 m-85 -59.27 83.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.917 0.389 . . . . 0.0 111.305 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -164.15 87.71 1.14 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.126 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -50.07 -46.55 27.7 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.591 2.194 . . . . 0.0 112.381 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 58.31 105.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.183 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.65 30.31 3.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.92 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 94.27 75.58 1.29 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.522 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -132.5 -178.11 4.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.798 0.332 . . . . 0.0 110.916 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt -60.33 145.68 46.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.888 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.12 155.49 22.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.813 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -121.0 40.54 3.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.965 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.081 179.987 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.105 0 N-CA-C 112.546 -0.222 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -157.83 33.75 0.26 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.757 0.313 . . . . 0.0 110.853 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.7 p-80 -107.63 -43.69 4.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.851 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 17.4 mtt -132.89 156.86 46.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.968 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -101.07 128.21 47.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.942 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.56 59.72 1.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.712 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.867 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -129.47 140.08 51.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.821 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.502 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -145.17 143.81 30.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.434 0.635 . . . . 0.0 112.632 -179.659 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 24.4 p -95.55 121.4 37.2 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.772 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.73 150.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.003 0.43 . . . . 0.0 111.282 -178.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.4 p -134.06 120.58 35.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.259 0.552 . . . . 0.0 111.522 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.723 HG11 HD22 ' A' ' 45' ' ' LEU . 11.5 m -94.17 104.53 15.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.382 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -98.63 105.28 17.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.419 . . . . 0.0 110.15 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.642 HD21 HG13 ' A' ' 52' ' ' VAL . 13.1 m120 -137.98 146.9 43.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.065 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -145.94 74.43 1.38 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.77 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.494 ' HB ' HD22 ' A' ' 29' ' ' LEU . 21.2 mt -101.22 -50.59 10.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.235 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -143.35 -99.36 0.12 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.013 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 168.43 43.51 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.183 0.516 . . . . 0.0 110.111 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.705 ' H ' HD12 ' A' ' 29' ' ' LEU . . . 149.28 66.05 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.404 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.664 ' CB ' HD11 ' A' ' 29' ' ' LEU . 15.9 t80 -111.82 59.23 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.003 0.43 . . . . 0.0 111.221 -179.013 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.472 ' HD3' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 33.68 83.83 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.439 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.661 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -85.34 54.27 3.05 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.647 179.38 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . 93.13 -24.1 0.05 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.462 0.305 . . . . 0.0 111.161 -179.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 152.22 -23.5 0.87 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.125 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -82.44 -2.14 52.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.691 0.281 . . . . 0.0 110.796 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 46.09 78.62 0.06 Allowed 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.43 0.633 . . . . 0.0 110.84 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.523 ' HB2' ' CB ' ' A' ' 22' ' ' ARG . 8.2 t80 -68.81 150.23 48.07 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.725 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -82.17 15.8 2.23 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.705 HD12 ' H ' ' A' ' 19' ' ' GLY . 0.7 OUTLIER 47.89 79.42 0.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.283 0.563 . . . . 0.0 111.27 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.436 ' HA2' ' O ' ' A' ' 14' ' ' ASN . . . -152.36 -135.18 2.18 Favored Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.473 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.404 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -120.63 116.14 24.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.758 0.314 . . . . 0.0 110.735 179.365 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 17.9 t30 -129.94 131.04 45.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.943 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.14 145.48 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.302 0.572 . . . . 0.0 111.121 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.966 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.72 140.46 46.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.26 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.966 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.26 157.63 37.35 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.11 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.867 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.6 112.13 5.88 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.685 0.755 . . . . 0.0 111.287 -177.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.553 ' N ' HG22 ' A' ' 7' ' ' THR . 4.1 t -127.77 168.26 21.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.088 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.656 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.524 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.7 t -55.09 -58.85 5.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.397 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -167.91 -17.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.5 m -43.43 -33.25 1.03 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.737 HE22 ' CG2' ' A' ' 55' ' ' ILE . 4.2 pp0? -66.52 -41.45 88.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.829 0.347 . . . . 0.0 111.837 -179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.478 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 4.8 tp -66.77 -34.36 77.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.501 -178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -91.94 -30.71 15.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.632 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.31 -42.42 88.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.947 0.403 . . . . 0.0 110.41 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.723 HD22 HG11 ' A' ' 12' ' ' VAL . 63.0 mt -79.04 -47.22 16.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.925 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.414 ' N ' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -60.44 -17.82 47.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.438 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.13 -39.87 6.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.801 0.334 . . . . 0.0 111.65 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.1 121.56 58.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -84.17 49.42 2.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.677 2.252 . . . . 0.0 112.774 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.23 -38.1 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.272 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.739 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -93.55 -165.59 1.36 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.426 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.672 ' O ' HG12 ' A' ' 12' ' ' VAL . 2.3 m -132.56 133.0 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.414 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.6 p -131.83 112.83 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.021 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.514 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.4 OUTLIER -127.66 126.21 41.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.837 -178.998 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.772 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.4 pp -88.11 126.66 41.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.042 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.1 p -122.21 104.55 9.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.62 -62.22 1.28 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.908 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 t -117.57 105.99 12.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.867 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.82 120.12 10.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.475 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -169.91 69.27 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.876 0.369 . . . . 0.0 110.859 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -164.2 89.24 0.54 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -98.55 30.66 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.901 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -135.12 154.18 21.48 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -172.91 127.12 1.33 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.52 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.78 -31.1 15.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.869 0.366 . . . . 0.0 110.851 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 137.02 -131.85 5.76 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.551 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mp -130.43 -175.58 3.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.821 0.343 . . . . 0.0 110.851 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -170.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.946 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.9 mttt -59.97 171.26 0.99 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -151.08 148.64 23.12 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.828 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.62 62.57 2.95 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.548 2.165 . . . . 0.0 112.323 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.76 142.15 29.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.071 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -140.97 54.67 0.63 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.483 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 64.47 -78.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.77 0.319 . . . . 0.0 110.98 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -137.62 177.63 7.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.902 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 60.29 81.99 0.17 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.885 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -130.97 -48.05 1.02 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.946 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 mttt 60.81 157.04 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -179.2 -37.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.0 mt -53.87 128.17 29.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.052 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -122.13 30.36 6.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.98 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -128.18 154.95 45.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.978 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.56 106.25 0.64 Allowed Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.063 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -62.69 155.4 59.31 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.511 2.141 . . . . 0.0 112.214 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.07 61.33 3.94 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.506 2.137 . . . . 0.0 112.173 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.9 m -151.26 150.64 30.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.617 HG22 ' H ' ' A' ' 89' ' ' LEU . 65.1 m 58.96 -86.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 58.52 38.49 25.43 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.804 0.335 . . . . 0.0 110.915 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.617 ' H ' HG22 ' A' ' 87' ' ' THR . 3.1 mm? -111.82 -17.67 12.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.431 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -49.07 -50.12 38.27 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.726 0.298 . . . . 0.0 111.132 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -13.05 25.9 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -94.84 122.82 37.86 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.643 0.259 . . . . 0.0 110.6 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.555 ' O ' HD11 ' A' ' 97' ' ' LEU . 15.9 p -117.98 -95.49 0.48 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.349 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.954 ' HA ' HD21 ' A' ' 97' ' ' LEU . 3.4 m -138.2 -34.87 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.89 0.376 . . . . 0.0 111.438 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -82.78 -20.41 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.283 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -38.22 21.98 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.954 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -76.3 -49.21 17.56 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.024 -0.671 . . . . 0.0 109.717 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.691 ' HE2' HD11 ' A' ' 117' ' ' LEU . 0.9 OUTLIER -56.44 -33.75 66.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.696 178.578 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.18 -25.76 27.21 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 111.973 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 3.5 mt-30 -86.68 -42.82 13.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.014 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.924 HD22 HG21 ' A' ' 106' ' ' ILE . 6.6 mt -54.48 -48.1 72.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.087 0.47 . . . . 0.0 110.385 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -39.64 92.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.062 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -6.85 52.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -106.17 -15.22 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.047 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.89 68.4 1.56 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.774 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.924 HG21 HD22 ' A' ' 101' ' ' LEU . 0.4 OUTLIER -119.28 -146.74 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.641 ' N ' HG23 ' A' ' 106' ' ' ILE . 4.8 t -150.78 105.11 3.24 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 122.169 -0.332 . . . . 0.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.656 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.8 p90 -142.92 66.28 1.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.948 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.35 -31.14 7.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.48 62.11 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.045 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 179.35 -38.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.024 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.656 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -112.49 108.31 17.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.017 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.75 -74.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.308 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.792 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -144.83 -43.89 0.24 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -78.78 -24.31 44.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.929 0.395 . . . . 0.0 110.569 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.6 mm-40 -85.94 -36.5 19.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.563 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.834 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -80.04 -19.71 46.97 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.204 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.834 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -27.01 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.654 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.99 -34.55 19.22 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.764 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.5 tp -51.57 -44.4 62.73 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.472 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.471 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 4.9 m-85 -54.75 -23.46 17.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.459 ' HA ' HD21 ' A' ' 89' ' ' LEU . . . -52.82 154.45 4.94 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.224 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.6 105.7 0.8 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.519 2.146 . . . . 0.0 112.293 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -160.66 90.69 0.87 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.045 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.69 91.15 4.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.97 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -112.36 -78.13 0.88 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.475 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -120.58 175.99 5.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.763 0.316 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.92 130.79 1.57 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.867 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 1.4 m -151.29 -178.18 6.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.87 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -72.2 -72.86 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.94 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.283 -0.865 . . . . 0.0 111.088 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 N-CA-C 112.429 -0.268 . . . . 0.0 112.429 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.31 -52.01 0.88 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.856 0.36 . . . . 0.0 110.91 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -99.49 31.44 3.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.93 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.95 138.98 48.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.825 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.6 167.86 14.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.943 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.4 mttp -121.4 85.73 2.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.939 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.749 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 5.6 t -134.45 129.86 35.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.761 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.08 152.25 38.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.098 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 2.6 m -92.4 124.96 36.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -110.12 151.18 12.41 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 111.659 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -138.01 132.9 43.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.368 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.646 HG12 ' O ' ' A' ' 52' ' ' VAL . 28.0 m -101.97 104.71 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.795 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.438 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -101.34 106.59 17.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.006 179.01 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.407 ' ND2' ' HA ' ' A' ' 29' ' ' LEU . 2.1 p-10 -125.77 145.79 50.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.253 0.549 . . . . 0.0 111.671 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.428 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.0 OUTLIER -126.97 74.98 1.54 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.46 178.637 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.31 115.23 5.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.708 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.747 ' O ' HD13 ' A' ' 29' ' ' LEU . 6.3 ptpt 39.57 -162.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.935 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -138.32 10.05 2.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.015 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -97.14 -28.94 8.27 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.07 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.16 98.81 0.04 OUTLIER 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.377 0.608 . . . . 0.0 109.723 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.511 ' HA ' ' C ' ' A' ' 26' ' ' SER . 17.6 ptt180 -155.65 150.47 26.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.593 -177.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 26' ' ' SER . 0.0 OUTLIER 171.7 -169.46 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.011 0.434 . . . . 0.0 111.77 179.381 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.12 66.38 7.68 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.331 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.409 ' HA2' ' CZ ' ' A' ' 27' ' ' PHE . . . 95.53 -20.15 50.95 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.481 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -75.05 -24.91 58.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.65 0.262 . . . . 0.0 111.139 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.811 ' HA ' HD21 ' A' ' 51' ' ' LEU . 72.1 p -176.4 160.95 2.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.823 0.344 . . . . 0.0 111.236 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD1' ' O ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -157.03 153.18 27.54 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.23 179.194 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -41.91 142.86 0.62 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.145 0.498 . . . . 0.0 111.582 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -52.3 91.05 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.156 179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -156.7 -146.97 4.62 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.417 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.438 ' HB3' ' CG ' ' A' ' 13' ' ' GLN . 3.5 p-10 -141.25 128.14 20.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.038 0.447 . . . . 0.0 111.265 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.427 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 16.2 m-20 -126.71 127.53 45.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.956 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.7 m -86.96 145.32 26.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.422 0.63 . . . . 0.0 111.739 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.957 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -111.51 138.22 48.32 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.698 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.957 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.48 156.41 39.41 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.923 0.392 . . . . 0.0 110.192 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.749 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.72 109.96 5.24 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.431 0.634 . . . . 0.0 111.723 -177.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.649 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -128.78 -177.01 1.74 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.039 -179.654 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.649 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -51.13 -64.85 0.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.366 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -177.75 -16.59 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.25 -34.47 0.78 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.586 ' HG2' HD11 ' A' ' 34' ' ' LEU . 1.4 pp0? -57.25 -49.87 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 0.0 111.232 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -56.14 -53.66 54.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.088 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.19 -27.0 64.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.216 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -64.5 -51.85 60.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.86 0.362 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.536 ' HG ' ' CG1' ' A' ' 12' ' ' VAL . 3.2 mm? -78.51 -32.18 47.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.088 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.653 ' HB2' HG11 ' A' ' 53' ' ' VAL . 13.8 tttt -75.11 -29.6 60.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.156 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -56.12 -62.84 1.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.6 120.43 81.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.83 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.41 59.91 6.85 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.514 2.142 . . . . 0.0 112.41 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.521 ' C ' HD13 ' A' ' 51' ' ' LEU . 1.9 mpt_? -115.91 -64.54 1.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.982 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -106.99 -176.82 3.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.566 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 12' ' ' VAL . 3.1 m -103.55 146.37 11.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.774 0.321 . . . . 0.0 111.782 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.653 HG11 ' HB2' ' A' ' 46' ' ' LYS . 4.8 p -126.66 116.72 45.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.805 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.743 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -127.41 139.54 52.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.336 -179.482 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.429 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -95.11 117.66 39.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.36 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.5 p -122.31 104.62 9.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.68 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.61 -65.94 0.57 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.975 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.471 HG22 ' H ' ' A' ' 59' ' ' GLY . 0.2 OUTLIER 60.45 -176.98 0.11 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.899 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.471 ' H ' HG22 ' A' ' 58' ' ' THR . . . -123.4 165.7 16.05 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.477 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 m -176.67 119.68 0.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.852 0.358 . . . . 0.0 110.866 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.04 -65.78 0.97 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.847 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -138.62 31.63 2.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.932 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 60.1 -139.8 48.22 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.462 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.28 -39.93 1.85 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.504 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.91 124.66 30.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.825 0.345 . . . . 0.0 110.887 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.04 28.16 3.98 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.45 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.586 HD12 ' HB2' ' A' ' 68' ' ' SER . 4.5 pp -153.83 160.32 42.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.819 0.342 . . . . 0.0 110.848 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.586 ' HB2' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER 68.55 -68.09 0.19 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.872 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.1 mttp -114.25 110.16 19.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.882 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.432 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER 179.28 -53.4 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.896 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.432 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 34.7 Cg_exo -57.61 -161.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.516 2.144 . . . . 0.0 112.243 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -91.9 175.96 6.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.069 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -96.67 137.56 13.41 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.41 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.5 p -107.98 179.37 4.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.793 0.33 . . . . 0.0 110.93 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -171.47 163.31 6.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.925 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 63.47 15.81 9.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.46 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 176.89 -179.48 0.19 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.824 0.345 . . . . 0.0 110.931 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mtpp -139.87 84.38 1.97 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.733 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -140.05 159.21 42.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.431 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -92.34 139.91 30.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.915 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.431 ' H ' HD13 ' A' ' 80' ' ' LEU . 61.0 mtp85 61.79 148.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.937 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -173.03 35.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -96.37 133.21 25.18 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.749 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.99 111.65 3.38 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.494 2.129 . . . . 0.0 112.351 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -56.43 -24.81 54.43 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.472 2.115 . . . . 0.0 112.27 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.1 m 63.34 -79.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.983 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -146.04 99.14 3.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.928 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -165.51 -45.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.819 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.491 ' N ' HD22 ' A' ' 89' ' ' LEU . 3.1 mm? -91.4 -32.44 15.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -48.93 -43.65 39.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.633 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.0 m -61.99 -14.19 32.88 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.533 ' CD1' ' CE2' ' A' ' 121' ' ' PHE . 24.0 m-85 -114.13 104.8 12.48 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.819 0.343 . . . . 0.0 110.644 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.409 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.2 OUTLIER -84.48 -86.58 0.12 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.164 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.798 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 11.3 t -148.25 -56.61 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.775 0.321 . . . . 0.0 111.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.44 -20.18 61.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.963 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -20.88 42.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.124 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.69 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -78.4 -58.56 3.19 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.401 -179.619 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.798 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.3 ptpt -62.14 -25.68 67.88 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.274 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.76 -29.55 25.38 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.021 0.438 . . . . 0.0 112.164 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 29.0 mt-30 -86.72 -29.4 22.43 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.738 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.852 HD22 ' HB ' ' A' ' 106' ' ' ILE . 6.0 mt -67.05 -46.29 74.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.22 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.729 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.988 179.553 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.97 -6.81 49.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.087 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.3 mtt-85 -106.44 -15.3 14.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.957 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.93 64.45 1.42 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.841 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.852 ' HB ' HD22 ' A' ' 101' ' ' LEU . 18.1 mt -151.16 100.49 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.66 0.267 . . . . 0.0 111.167 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -57.18 122.25 12.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.84 0.352 . . . . 0.0 110.921 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.729 ' HE1' HG23 ' A' ' 102' ' ' THR . 13.8 p90 -130.56 5.54 4.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.547 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -99.14 31.48 3.03 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 0.0 110.91 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.38 25.97 0.6 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.5 p 177.19 -37.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.914 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.466 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -82.99 175.89 9.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.3 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.552 ' O ' HD13 ' A' ' 117' ' ' LEU . 25.0 p -150.55 -80.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.748 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.5 pttt -145.35 -46.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.458 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.59 -25.2 41.6 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 0.0 110.264 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.14 -36.73 19.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.401 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.925 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -79.7 -19.42 48.96 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.054 -179.505 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.925 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.74 -30.18 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 120.874 0.369 . . . . 0.0 110.268 178.502 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.83 -32.38 19.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.286 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.837 HD11 HD21 ' A' ' 101' ' ' LEU . 1.5 pp -72.5 -17.11 61.77 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.633 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -20.46 91.18 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.405 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . 64.35 86.55 0.14 Allowed Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.137 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.459 ' CD ' HD13 ' A' ' 106' ' ' ILE . 64.5 Cg_endo -73.66 61.25 4.45 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.551 2.167 . . . . 0.0 112.328 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 67.58 -71.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.092 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -78.32 146.36 34.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 116.88 105.99 2.42 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.541 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -141.72 -49.44 0.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.9 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -170.15 158.3 6.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.9 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 37.8 m -133.9 150.31 51.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -139.02 36.24 2.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.892 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.094 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.527 -0.229 . . . . 0.0 112.527 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.9 t -75.48 -67.73 0.63 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.84 0.352 . . . . 0.0 110.913 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -163.91 93.18 0.71 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -80.85 137.96 36.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.768 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -174.45 -40.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.081 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.53 76.86 3.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.119 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.75 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 9.5 t -162.16 130.03 4.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.647 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.07 146.03 29.85 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.4 m -94.63 115.86 28.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.879 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -110.27 151.74 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.131 0.491 . . . . 0.0 112.061 -178.312 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.562 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.3 p -138.08 128.2 35.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.151 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.062 HG13 HD13 ' A' ' 45' ' ' LEU . 23.4 m -96.78 104.81 16.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.921 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -92.94 106.53 18.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.024 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.916 ' CB ' HD22 ' A' ' 51' ' ' LEU . 21.8 p-10 -105.47 121.95 45.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.089 0.471 . . . . 0.0 112.185 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -105.49 25.91 10.14 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.675 HG22 ' HG2' ' A' ' 17' ' ' LYS . 6.1 mt -87.27 -60.13 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.576 -178.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.675 ' HG2' HG22 ' A' ' 16' ' ' ILE . 29.1 pttt -176.71 -172.62 0.45 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.669 0.271 . . . . 0.0 111.111 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.422 ' HB3' ' HB2' ' A' ' 29' ' ' LEU . 12.2 pt-20 -113.57 13.33 18.74 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.952 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.61 -20.44 10.12 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.373 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.516 ' O ' ' HB2' ' A' ' 27' ' ' PHE . 2.0 t80 -69.05 99.05 1.04 Allowed 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.198 0.523 . . . . 0.0 109.833 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 27.9 ptt180 -176.36 -178.18 0.93 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.713 -178.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.477 ' HB2' ' HB2' ' A' ' 26' ' ' SER . 0.6 OUTLIER -76.73 -50.59 13.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.046 0.45 . . . . 0.0 110.225 179.42 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -178.04 34.85 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.577 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 93.73 15.66 48.65 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.254 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.75 44.08 1.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.934 0.397 . . . . 0.0 110.627 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -160.1 -38.3 0.05 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.518 -179.776 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.516 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 71.8 m-85 -156.03 159.05 38.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.028 0.442 . . . . 0.0 111.668 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.421 ' CG ' ' O ' ' A' ' 27' ' ' PHE . 22.0 m-70 -160.23 173.67 15.38 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.365 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 18' ' ' GLU . 21.4 tp -75.9 99.92 4.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.001 0.429 . . . . 0.0 110.66 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.57 -139.9 6.48 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.234 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.422 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -136.45 122.86 20.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.005 0.431 . . . . 0.0 111.114 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.0 t30 -107.1 122.0 45.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.871 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.1 p -86.7 145.45 26.68 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.538 0.685 . . . . 0.0 111.544 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.934 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -117.2 139.12 51.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.25 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.934 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.85 156.93 38.96 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 120.825 0.345 . . . . 0.0 110.102 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.75 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.23 107.07 3.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.474 0.654 . . . . 0.0 111.544 -177.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.695 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -124.66 -175.91 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.296 -179.401 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.695 ' N ' HG23 ' A' ' 37' ' ' VAL . 16.4 m -51.68 -68.02 0.2 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.528 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -176.1 -21.43 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.4 -35.23 0.97 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.882 0.372 . . . . 0.0 111.478 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.733 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.22 -39.03 69.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.52 179.81 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.496 HD13 ' CG2' ' A' ' 55' ' ' ILE . 6.1 tp -70.58 -39.67 73.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.775 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.47 -27.37 56.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.53 -45.02 66.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.009 0.433 . . . . 0.0 110.491 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 1.062 HD13 HG13 ' A' ' 12' ' ' VAL . 51.4 mt -78.7 -30.6 46.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.014 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -69.84 -19.65 63.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.224 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.14 -55.01 27.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.38 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.41 118.65 64.38 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.999 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -81.85 54.7 5.17 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.632 2.221 . . . . 0.0 112.394 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.56 ' CG ' HD13 ' A' ' 16' ' ' ILE . 3.4 tpt180 -149.14 -63.28 0.23 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.719 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.916 HD22 ' CB ' ' A' ' 14' ' ' ASN . 18.1 mt -63.66 175.93 0.99 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.489 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' VAL . 3.4 m -120.55 123.06 69.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.493 HG22 HD12 ' A' ' 42' ' ' LEU . 2.0 p -116.9 106.28 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 0.0 110.299 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.517 ' O ' HG22 ' A' ' 10' ' ' VAL . 5.0 mt-30 -127.48 131.21 50.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.021 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.879 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.07 119.24 35.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.264 0.554 . . . . 0.0 111.622 -179.538 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 p -122.79 104.61 9.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.466 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 59' ' ' GLY . 6.4 tt0 -74.4 61.5 0.92 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.036 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.7 m 63.92 -74.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.116 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 57' ' ' GLU . . . 134.41 84.79 0.22 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.278 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.4 m 63.46 117.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.739 0.304 . . . . 0.0 110.701 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 61.89 150.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.881 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -119.8 167.75 11.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.898 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 111.37 -109.61 2.56 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.46 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -127.03 145.95 16.07 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.528 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -135.03 36.13 3.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.863 0.363 . . . . 0.0 110.889 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 152.14 109.11 0.4 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.527 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -88.41 -72.94 0.51 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.813 0.34 . . . . 0.0 110.811 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.6 m -93.67 146.92 23.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.05 122.68 1.59 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.962 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -166.84 166.19 8.9 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.852 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -83.81 42.69 1.26 Allowed 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.101 2.534 . . . . 0.0 112.703 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 54.15 101.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.821 0.343 . . . . 0.0 111.372 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.05 80.69 0.82 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.456 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 t -111.26 -57.41 2.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.749 0.309 . . . . 0.0 110.917 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.35 -175.58 3.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -99.38 -75.99 0.55 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.4 -40.39 2.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.969 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? 63.43 41.18 7.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.86 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.679 ' C ' HD23 ' A' ' 80' ' ' LEU . 4.7 mt-30 -155.65 -173.92 4.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.855 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.679 HD23 ' C ' ' A' ' 79' ' ' GLN . 0.9 OUTLIER 46.11 -169.34 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.364 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.17 173.45 6.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -154.84 152.32 29.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.122 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.4 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.7 OUTLIER -114.03 136.82 22.2 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.771 179.941 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.463 ' N ' ' CD ' ' A' ' 85' ' ' PRO . 31.8 Cg_exo -57.72 -46.76 24.64 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.261 1.974 . . . . 0.0 112.428 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 84' ' ' PRO . 42.3 Cg_exo -56.65 -38.68 95.08 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.394 2.063 . . . . 0.0 112.255 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.6 m -94.19 169.04 10.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.978 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.9 t -178.47 -39.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.705 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.401 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 18.4 p30 -166.89 151.51 7.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.669 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.401 ' CB ' ' O ' ' A' ' 88' ' ' ASP . 0.6 OUTLIER 80.26 -49.48 0.34 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -48.86 -47.34 42.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.475 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.9 p -62.14 -12.78 21.52 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -115.46 122.43 45.73 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.674 0.273 . . . . 0.0 110.435 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.438 ' N ' HD11 ' A' ' 97' ' ' LEU . 93.5 m -84.75 -98.69 0.06 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.48 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.778 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 43.3 t -142.31 -56.84 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.075 0 CA-C-O 120.816 0.341 . . . . 0.0 111.361 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.25 -20.13 61.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.819 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.52 -21.18 38.76 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.083 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.768 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -75.35 -58.74 3.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.357 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.86 ' O ' HG23 ' A' ' 102' ' ' THR . 1.8 ptpt -57.82 -26.9 62.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.95 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.09 29.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.044 0.45 . . . . 0.0 111.663 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -86.79 -38.28 17.02 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 101' ' ' LEU . 22.8 mt -63.83 -42.64 97.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.662 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.86 HG23 ' O ' ' A' ' 98' ' ' LYS . 12.7 p -65.73 -40.82 92.56 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.113 0.482 . . . . 0.0 109.907 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -6.91 50.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.348 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 36.6 mtt180 -106.03 -15.27 14.94 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.158 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.35 42.25 5.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.598 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 23.4 mm -128.41 92.27 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.714 0.293 . . . . 0.0 111.201 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 p -57.75 151.13 18.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.847 0.356 . . . . 0.0 110.864 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.66 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.3 p90 -153.5 36.66 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.017 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -45.41 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -134.72 24.47 3.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.005 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 -33.58 4.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.993 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.66 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -139.67 119.64 13.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.142 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.499 ' O ' HD13 ' A' ' 117' ' ' LEU . 68.6 p -92.21 -73.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.693 ' O ' HG22 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -145.25 -40.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -24.05 32.77 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.5 mm-40 -86.08 -38.46 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.434 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.922 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -76.25 -19.91 57.9 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.587 -0.278 . . . . 0.0 111.213 -179.318 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.922 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.6 -33.17 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.249 -0.58 . . . . 0.0 109.582 177.927 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.43 -28.28 22.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.462 ' O ' ' N ' ' A' ' 122' ' ' ALA . 18.5 tp -48.77 -43.79 38.17 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.252 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.55 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 9.2 m-85 -45.42 90.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.535 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.462 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -116.24 154.71 48.76 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.973 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -65.22 -177.57 0.66 Allowed 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.564 2.176 . . . . 0.0 112.198 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -58.44 111.69 1.32 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.058 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -114.16 -179.95 3.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.875 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 133.27 -172.14 21.6 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.589 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -125.43 64.95 1.16 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.869 0.366 . . . . 0.0 110.946 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.1 mttt 60.07 159.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 66.47 -73.47 0.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.936 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 63.44 99.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.87 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.316 -0.85 . . . . 0.0 111.104 179.983 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.528 -0.229 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -130.15 93.98 3.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.869 0.366 . . . . 0.0 110.841 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.4 m-70 -119.85 -40.92 2.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.954 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -159.76 -44.54 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.895 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -84.77 151.75 24.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.021 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 48.8 tttm -176.81 38.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.72 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.92 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -158.8 139.43 12.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.695 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.518 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.81 145.68 31.76 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.8 p -94.12 133.15 37.92 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.738 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -109.98 148.3 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.522 0.677 . . . . 0.0 111.85 -178.935 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.9 p -138.15 101.18 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.958 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.068 HG21 HD22 ' A' ' 45' ' ' LEU . 78.9 t -92.6 136.71 24.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.196 -178.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -119.3 112.45 19.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.572 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 141.56 29.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.05 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.445 ' HA ' HD22 ' A' ' 29' ' ' LEU . 1.2 ptt180 -141.09 31.52 1.76 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.385 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.592 HG22 ' CG ' ' A' ' 17' ' ' LYS . 2.2 mp -99.65 -59.61 3.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.178 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.592 ' CG ' HG22 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -160.75 179.15 8.77 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.51 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -109.2 2.5 20.99 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.766 0.317 . . . . 0.0 111.039 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.94 -13.02 54.62 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.351 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.477 ' HD2' HD11 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -86.8 102.63 14.46 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.438 0.637 . . . . 0.0 109.889 179.604 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptt180 -139.72 143.44 37.03 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.266 -178.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.466 ' O ' ' CE1' ' A' ' 27' ' ' PHE . 1.5 ttm105 177.2 -165.36 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.931 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.41 64.92 8.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.892 0.377 . . . . 0.0 111.017 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.84 -38.08 3.23 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.234 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.528 ' O ' HD21 ' A' ' 51' ' ' LEU . 89.7 m-85 -62.19 -19.01 62.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.688 0.28 . . . . 0.0 111.119 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.416 ' HB3' ' CG ' ' A' ' 20' ' ' TYR . 5.5 m -165.67 148.86 7.8 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.597 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.466 ' CE1' ' O ' ' A' ' 22' ' ' ARG . 2.1 m-30 -154.64 161.65 41.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.947 0.403 . . . . 0.0 111.176 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -60.18 -179.7 0.12 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.555 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 15' ' ' ARG . 15.1 mt -84.09 103.5 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.18 0.514 . . . . 0.0 110.987 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 170.21 -144.1 8.24 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.34 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -147.92 128.36 14.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.858 0.361 . . . . 0.0 110.998 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.4 p-10 -124.75 133.12 53.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.21 145.61 26.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.069 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.943 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -113.33 143.07 45.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.191 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.943 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.62 156.72 39.09 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-O 121.091 0.472 . . . . 0.0 110.402 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.92 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.24 115.64 9.67 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.415 0.626 . . . . 0.0 111.551 -177.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.626 HG23 ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -129.72 -173.24 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.958 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.626 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -65.35 -59.19 4.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.552 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -171.2 -16.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.1 m -42.23 -40.82 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.616 ' NE2' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.37 -43.04 83.2 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.216 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.557 HD13 HG23 ' A' ' 55' ' ' ILE . 19.7 tp -64.52 -55.36 21.11 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.194 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.736 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.99 -23.14 62.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.537 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.25 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.861 0.362 . . . . 0.0 110.276 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 1.068 HD22 HG21 ' A' ' 12' ' ' VAL . 0.8 OUTLIER -78.93 -57.47 3.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.931 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.487 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -51.85 -23.27 4.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.609 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.736 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -43.37 -31.43 0.67 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.781 0.324 . . . . 0.0 111.498 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.04 128.01 24.59 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.683 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.95 77.42 2.73 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.426 2.084 . . . . 0.0 112.22 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.61 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -146.54 -45.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.184 -179.846 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.61 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -110.61 124.8 52.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.974 0.416 . . . . 0.0 110.827 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.413 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.0 t -64.7 106.06 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.625 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.828 ' HA ' HG22 ' A' ' 12' ' ' VAL . 2.9 p -99.03 123.97 51.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.147 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.738 ' O ' HG22 ' A' ' 10' ' ' VAL . 19.8 pt20 -127.0 141.09 51.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.081 -178.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.557 HG23 HD13 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -100.58 112.7 34.15 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.039 179.539 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 56' ' ' THR . 3.3 t -122.42 104.67 9.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.609 ' O ' HG23 ' A' ' 58' ' ' THR . 0.7 OUTLIER -98.02 62.06 1.54 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.839 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.609 HG23 ' O ' ' A' ' 57' ' ' GLU . 2.4 p -162.66 174.76 12.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.876 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 104.34 165.2 24.64 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.523 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.6 m -135.45 80.04 1.81 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.347 . . . . 0.0 110.926 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -153.09 141.55 20.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.881 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -102.87 117.23 34.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.927 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.61 175.91 19.13 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.536 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.782 ' HA3' HD12 ' A' ' 67' ' ' LEU . . . -144.19 -58.42 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.526 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 60.6 30.97 20.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.53 68.44 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.782 HD12 ' HA3' ' A' ' 64' ' ' GLY . 0.6 OUTLIER -110.57 24.73 12.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.674 0.274 . . . . 0.0 110.909 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.7 m -165.18 175.94 8.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.954 0.407 . . . . 0.0 110.796 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -115.11 -38.9 3.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.793 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -164.35 141.54 5.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.38 -61.9 0.4 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.482 2.121 . . . . 0.0 112.271 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.01 -47.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.065 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.91 -86.94 0.34 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.475 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.0 p 49.67 88.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.82 0.343 . . . . 0.0 111.216 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 63.63 135.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -118.29 -36.3 3.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.068 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -119.19 179.97 4.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.924 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.84 55.29 0.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.815 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 63.06 142.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.948 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.0 mt -147.61 78.73 1.47 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.869 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.86 148.92 50.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.768 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -177.12 -37.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.271 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.2 t0 69.77 78.94 0.22 Allowed Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.882 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.482 ' N ' ' HD2' ' A' ' 85' ' ' PRO . 2.3 Cg_endo -42.8 -57.65 1.62 Allowed 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.919 2.413 . . . . 0.0 112.828 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 84' ' ' PRO . 19.5 Cg_endo -59.43 -70.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.27 1.98 . . . . 0.0 112.245 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.6 t 63.47 131.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.985 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.4 m 59.48 160.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.953 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.445 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 4.9 m-20 58.58 165.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 2.3 mm? 70.1 -46.26 0.6 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.824 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -48.44 -45.02 35.91 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.565 0.221 . . . . 0.0 111.288 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 p -62.11 -13.21 24.48 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.404 ' HB3' HD12 ' A' ' 97' ' ' LEU . 5.7 m-85 -90.07 115.61 27.47 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.681 0.277 . . . . 0.0 110.427 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.785 HG22 HG22 ' A' ' 94' ' ' VAL . 90.4 m -91.22 -107.46 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.778 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.822 ' HA ' HD21 ' A' ' 97' ' ' LEU . 10.0 m -135.61 -32.02 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.25 0 CA-C-O 120.916 0.389 . . . . 0.0 111.494 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -83.58 -20.0 34.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.736 0.303 . . . . 0.0 111.068 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.6 OUTLIER -81.53 -32.61 32.21 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.571 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.832 HD13 ' H ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -77.87 -50.03 13.07 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -179.788 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.568 ' H ' HD22 ' A' ' 97' ' ' LEU . 3.3 ptpt -62.24 -28.11 69.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.86 -30.39 24.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.963 0.411 . . . . 0.0 111.98 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -86.82 -27.9 23.24 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.675 HD22 HG21 ' A' ' 106' ' ' ILE . 6.5 mt -64.73 -47.23 79.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.261 0.553 . . . . 0.0 109.742 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -34.83 74.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.749 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.28 -12.57 61.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.314 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.57 ' HD3' HD23 ' A' ' 101' ' ' LEU . 9.6 ptm180 -110.89 -15.26 13.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.052 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.05 82.72 0.79 Allowed Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.791 -0.718 . . . . 0.0 113.16 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.675 HG21 HD22 ' A' ' 101' ' ' LEU . 8.4 tp -126.74 -40.83 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.698 0.285 . . . . 0.0 111.376 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.431 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.2 OUTLIER 73.65 90.83 0.09 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.846 0.355 . . . . 0.0 110.624 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.91 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 14.1 p90 -115.26 139.03 50.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.114 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -43.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.788 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -128.22 27.41 5.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.67 30.27 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.97 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.91 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -178.46 59.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.015 0.436 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.607 ' O ' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -59.79 -83.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.7 ' HA ' HD22 ' A' ' 117' ' ' LEU . 4.3 ptpt -139.62 -43.79 0.44 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.812 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.86 -24.5 41.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.998 0.428 . . . . 0.0 110.253 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -86.19 -36.55 19.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.837 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.93 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.97 -21.57 50.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.375 -179.145 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.93 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.12 -27.54 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.148 177.677 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.21 -34.17 19.09 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.143 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.7 OUTLIER -49.33 -46.26 46.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.871 -179.003 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.613 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 53.0 m-85 -54.68 86.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.399 . . . . 0.0 111.348 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.44 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -127.88 152.64 77.55 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.946 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.94 92.41 0.21 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.595 2.196 . . . . 0.0 112.278 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -130.08 138.11 50.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.093 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 8.8 t70 60.15 160.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 151.16 44.68 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.491 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -80.75 169.87 17.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.829 0.347 . . . . 0.0 110.918 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 7.5 tptt -155.62 -51.27 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.857 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.1 121.37 14.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -149.91 97.46 2.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.882 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.048 179.995 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.14 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m -110.33 106.35 15.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.825 0.345 . . . . 0.0 110.834 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -108.45 159.22 16.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.009 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 20.5 ptm 42.56 87.61 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.535 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.14 110.21 7.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.904 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.45 99.58 2.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.989 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.787 HG22 ' C ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -84.86 135.95 33.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.598 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.472 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.15 146.46 31.79 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.523 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.3 p -96.9 119.81 36.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.755 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.76 151.55 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.176 0.513 . . . . 0.0 111.633 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.564 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -134.94 126.27 46.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.086 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.065 HG13 HD13 ' A' ' 45' ' ' LEU . 9.0 m -95.86 104.77 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.341 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -88.82 106.56 18.46 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.846 ' HB2' HD12 ' A' ' 16' ' ' ILE . 1.0 OUTLIER -98.22 144.11 28.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.447 0.641 . . . . 0.0 111.946 -179.294 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.617 ' HG3' HD21 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -139.12 35.29 2.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.607 178.361 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.846 HD12 ' HB2' ' A' ' 14' ' ' ASN . 2.8 mp -77.02 -61.81 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.578 -178.174 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.836 ' HG2' HG22 ' A' ' 16' ' ' ILE . 11.8 ptpt 177.39 32.32 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.43 ' HA ' ' N ' ' A' ' 29' ' ' LEU . 0.1 OUTLIER 51.89 26.0 3.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.715 0.293 . . . . 0.0 111.274 179.608 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -179.07 77.52 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.354 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.424 ' CE2' ' HG2' ' A' ' 50' ' ' ARG . 41.7 t80 -150.17 32.73 0.66 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.923 0.392 . . . . 0.0 110.934 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.5 mmt-85 60.56 170.69 0.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.609 179.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.527 ' HG2' HD22 ' A' ' 51' ' ' LEU . 1.4 tmm_? 179.92 -70.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.819 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.58 13.19 30.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.141 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.44 29.32 3.98 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.85 -0.691 . . . . 0.0 111.395 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.25 162.04 8.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.672 -0.264 . . . . 0.0 110.398 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.12 80.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.768 0.318 . . . . 0.0 110.682 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.427 ' CZ ' ' HB2' ' A' ' 32' ' ' ASN . 5.8 t80 -60.78 128.47 36.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.896 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -69.45 155.2 40.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.64 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.617 HD21 ' HG3' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -64.03 94.57 0.1 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.157 0.503 . . . . 0.0 110.511 179.902 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -167.36 -133.45 1.54 Allowed Glycine 0 N--CA 1.45 -0.433 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.871 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.559 ' HB2' HG22 ' A' ' 11' ' ' VAL . 36.4 p-10 -157.09 142.14 17.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.908 0.385 . . . . 0.0 111.483 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.8 t-20 -122.01 136.46 54.92 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.083 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.02 145.2 26.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.492 0.663 . . . . 0.0 111.715 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.938 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -111.97 141.44 45.63 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.885 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.938 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.39 157.58 37.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.393 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.787 ' C ' HG22 ' A' ' 7' ' ' THR . . . -69.5 112.02 5.73 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.622 0.725 . . . . 0.0 111.243 -177.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.543 ' N ' HG22 ' A' ' 7' ' ' THR . 5.3 t -127.84 168.62 20.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.64 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.525 ' H ' HG12 ' A' ' 37' ' ' VAL . 19.4 t -54.36 -62.07 1.9 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.525 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -164.92 -16.61 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.42 -45.27 4.31 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.687 HE22 ' CG2' ' A' ' 55' ' ' ILE . 2.5 pp0? -53.4 -47.04 69.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.801 0.334 . . . . 0.0 111.693 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.437 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 8.7 tp -57.89 -46.56 84.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.518 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.18 -28.44 48.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.661 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -50.69 67.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.938 0.399 . . . . 0.0 110.712 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 1.065 HD13 HG13 ' A' ' 12' ' ' VAL . 32.4 mt -79.0 -34.3 44.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.414 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.57 ' N ' HG11 ' A' ' 53' ' ' VAL . 1.7 ttmt -77.7 -10.27 59.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.322 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.47 -45.54 73.19 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.717 0.294 . . . . 0.0 111.261 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -93.28 127.95 44.7 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -79.31 85.79 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.518 2.145 . . . . 0.0 112.565 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.424 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -167.13 -72.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.855 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.651 ' HG ' HD11 ' A' ' 16' ' ' ILE . 6.1 mp -64.47 171.03 3.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.609 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.5 t -115.35 106.75 21.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.927 0.394 . . . . 0.0 111.908 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.57 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.3 p -104.02 111.19 32.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.05 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.508 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.3 mm-40 -127.17 133.54 50.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.523 -179.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.755 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.31 133.37 30.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.119 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.3 p -122.27 104.57 9.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.792 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -61.89 1.35 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.909 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.3 t -153.1 -46.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.885 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.3 -161.51 30.17 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.534 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.29 -36.65 20.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.878 0.37 . . . . 0.0 110.984 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -174.62 -60.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -175.21 -56.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.953 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 94.92 146.43 20.72 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.54 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.18 47.47 0.27 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.473 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -126.78 41.81 3.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.923 0.392 . . . . 0.0 110.856 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 133.64 -28.43 3.25 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.51 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.2 tt -95.5 113.1 24.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 110.908 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.73 -76.8 0.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.856 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm -149.65 -47.98 0.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.954 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -117.84 113.25 38.04 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.866 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -77.12 -0.99 11.14 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.494 2.129 . . . . 0.0 112.807 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -52.96 -76.17 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.806 0.336 . . . . 0.0 111.289 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 142.34 -53.94 0.62 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.497 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.81 32.56 18.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.787 0.327 . . . . 0.0 110.914 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.72 -48.56 3.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.868 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.37 158.57 25.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.907 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -143.25 -48.82 0.32 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.17 174.36 10.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.5 105.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.875 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.552 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -118.09 142.03 47.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.552 ' H ' HD13 ' A' ' 80' ' ' LEU . 4.7 ttt85 -61.35 -176.15 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -94.07 170.75 9.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.096 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.55 145.84 50.54 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -51.81 104.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.632 2.221 . . . . 0.0 112.292 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -65.98 69.36 0.4 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.674 2.249 . . . . 0.0 112.161 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.8 p -159.11 109.02 1.95 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.928 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 39.0 m -144.77 -47.12 0.24 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.903 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -141.0 -46.94 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.877 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 89' ' ' LEU . 8.7 tp -62.38 -18.7 62.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.294 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -49.17 -50.25 38.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.655 0.265 . . . . 0.0 111.125 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.22 -10.18 14.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.439 ' CD1' ' HA ' ' A' ' 89' ' ' LEU . 4.4 m-85 -88.29 120.92 30.11 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.6 0.238 . . . . 0.0 110.528 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.6 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -133.8 -91.48 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.876 ' HA ' HD21 ' A' ' 97' ' ' LEU . 20.4 t -131.39 -44.58 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 121.027 0.441 . . . . 0.0 111.65 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.428 ' O ' ' HB3' ' A' ' 99' ' ' ALA . 5.7 pt-20 -82.29 -19.99 38.39 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -85.72 -29.29 24.04 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.876 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -84.59 -55.24 4.23 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.453 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.802 ' HE2' HD11 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -55.13 -32.83 62.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.794 178.765 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 95' ' ' GLU . . . -85.36 -24.85 27.42 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.989 0.423 . . . . 0.0 112.086 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 71.5 mt-30 -86.57 -45.29 11.2 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.923 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.531 HD22 ' HB ' ' A' ' 106' ' ' ILE . 4.7 mt -50.89 -49.05 60.16 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.994 0.426 . . . . 0.0 110.38 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.589 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -66.66 -38.27 86.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.113 179.599 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -77.17 -6.69 53.92 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.333 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -104.07 -15.18 15.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.215 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.57 ' O ' HD13 ' A' ' 106' ' ' ILE . . . 88.98 47.02 4.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.549 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.57 HD13 ' O ' ' A' ' 105' ' ' GLY . 21.7 mm -133.38 91.21 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 0.0 111.078 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 27.3 p -54.64 119.82 5.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.953 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.589 ' HE1' HG23 ' A' ' 102' ' ' THR . 14.6 p90 -117.5 74.24 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.873 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.29 39.81 2.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.759 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -121.49 -47.03 2.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.013 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.16 33.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.039 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -116.66 90.1 3.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.987 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.84 -76.67 0.15 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.04 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.541 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -147.21 -39.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.417 ' HA ' HG22 ' A' ' 118' ' ' ILE . . . -77.57 -22.12 51.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 110.658 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 12.7 mm-40 -85.58 -37.96 18.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.85 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.864 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -82.37 -19.89 38.28 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.302 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.864 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.64 -25.24 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.589 177.749 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.72 -35.38 19.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.392 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -33.51 74.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.456 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 0.8 OUTLIER -60.29 84.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.258 -179.702 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.53 126.7 90.74 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.844 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.91 151.35 84.34 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.424 2.083 . . . . 0.0 112.353 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -99.84 136.92 39.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.094 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -176.77 -40.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.847 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -109.75 -110.94 3.35 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.483 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 43.73 60.43 2.67 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 111.399 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -96.93 88.1 4.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.97 102.24 3.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.808 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -122.78 117.81 26.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.962 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.215 179.965 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.0 p -86.05 161.63 18.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.772 0.32 . . . . 0.0 111.016 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -144.3 158.26 43.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.901 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 ttm -100.66 171.77 7.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.837 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 61.89 73.88 0.46 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.148 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.07 65.85 0.92 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.387 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.913 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -165.68 147.5 7.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.467 -179.36 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.586 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -144.9 135.29 24.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.675 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -89.74 119.98 30.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.835 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.88 156.0 10.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.905 0.383 . . . . 0.0 111.759 -177.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.22 117.48 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.069 0.461 . . . . 0.0 110.718 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.846 HG21 ' NH2' ' A' ' 22' ' ' ARG . 27.1 m -93.14 110.37 23.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.166 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -91.86 111.54 23.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.49 144.48 26.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.301 0.572 . . . . 0.0 111.595 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.645 ' HA ' HD22 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -143.06 33.99 1.36 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.792 179.139 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.626 HG22 ' HG3' ' A' ' 17' ' ' LYS . 3.2 mp -99.27 -58.3 3.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.589 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.626 ' HG3' HG22 ' A' ' 16' ' ' ILE . 2.9 mttt -151.86 -178.54 6.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.632 0.253 . . . . 0.0 110.862 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.83 37.78 1.87 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.897 0.379 . . . . 0.0 110.776 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.12 74.88 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.28 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.565 ' O ' ' HD2' ' A' ' 21' ' ' ARG . 3.1 t80 -132.08 98.82 4.53 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.806 0.336 . . . . 0.0 110.365 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.565 ' HD2' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 47.41 175.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.697 179.611 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.846 ' NH2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER 71.52 178.28 0.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.139 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.574 ' HB2' ' CD2' ' A' ' 27' ' ' PHE . . . 59.93 11.82 2.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.448 -178.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.438 ' O ' ' HB3' ' A' ' 25' ' ' PHE . . . 83.98 14.01 73.33 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.974 -0.632 . . . . 0.0 112.223 -179.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.438 ' HB3' ' O ' ' A' ' 24' ' ' GLY . 0.2 OUTLIER 178.21 -46.51 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.48 ' HA ' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER 174.54 118.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.252 -179.449 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.574 ' CD2' ' HB2' ' A' ' 23' ' ' ALA . 2.0 t80 -85.36 156.41 20.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.344 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -85.07 175.77 8.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.098 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.645 HD22 ' HA ' ' A' ' 15' ' ' ARG . 8.4 mt -65.75 93.45 0.18 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.046 0.451 . . . . 0.0 110.638 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -168.41 -139.41 2.69 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.55 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 22.8 p-10 -152.41 146.95 25.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.841 0.353 . . . . 0.0 111.007 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.431 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 2.2 t30 -125.0 135.48 52.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.411 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.5 m -87.11 145.5 26.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.343 0.592 . . . . 0.0 111.069 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.918 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -114.26 140.2 48.78 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.981 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.918 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.17 157.55 37.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.005 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.913 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.38 106.43 2.93 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.769 0.795 . . . . 0.0 111.168 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 35' ' ' ALA . 5.0 t -124.53 167.61 18.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 114.36 -1.291 . . . . 0.0 110.705 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.506 ' N ' HG12 ' A' ' 37' ' ' VAL . 0.7 OUTLIER -55.51 -64.95 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.433 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -160.25 -16.37 0.05 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.6 m -42.19 -38.14 1.65 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.883 HE22 HG22 ' A' ' 55' ' ' ILE . 1.4 pp0? -63.22 -53.38 54.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.911 0.386 . . . . 0.0 111.309 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.0 tp -57.78 -28.31 63.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.511 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -90.41 -40.47 12.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.683 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.6 tm0? -62.21 -40.73 97.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.808 0.337 . . . . 0.0 110.756 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.772 HD12 ' CG2' ' A' ' 53' ' ' VAL . 7.3 mt -78.84 -39.83 34.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.257 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -65.98 -12.89 58.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.537 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.46 -28.84 2.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.681 0.277 . . . . 0.0 111.504 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -129.48 110.02 17.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.13 -22.66 11.32 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.655 2.237 . . . . 0.0 112.654 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -45.79 -63.7 0.91 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.879 0.371 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.02 170.4 16.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.8 t -119.44 108.28 23.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.884 0.373 . . . . 0.0 111.679 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.772 ' CG2' HD12 ' A' ' 45' ' ' LEU . 1.5 p -105.89 111.32 34.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.494 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.546 ' O ' HG22 ' A' ' 10' ' ' VAL . 16.0 mt-30 -127.52 130.9 49.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.583 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.883 HG22 HE22 ' A' ' 41' ' ' GLN . 2.6 pp -88.13 145.35 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.064 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.1 p -122.26 104.55 9.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.684 179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.39 84.65 1.47 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.708 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.9 p -47.74 95.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.207 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 154.87 -64.41 0.33 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.86 -0.685 . . . . 0.0 112.407 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.5 t 62.66 -80.03 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.756 0.312 . . . . 0.0 111.132 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -118.81 168.88 10.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.866 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -79.43 81.16 5.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.896 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.46 141.54 11.03 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.479 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 143.15 -149.81 21.72 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.475 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 61.14 114.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.91 0.386 . . . . 0.0 110.873 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 178.28 -36.14 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.483 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.55 -30.95 70.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.767 0.318 . . . . 0.0 110.788 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.5 m 60.67 177.23 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.767 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB3' ' HD2' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -71.63 -72.43 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.851 179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.448 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 1.6 mt-10 172.34 -53.84 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.215 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.448 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 28.0 Cg_exo -62.08 168.77 8.59 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.472 2.114 . . . . 0.0 112.289 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.48 -38.65 3.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.137 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -87.41 162.08 33.07 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.539 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 m -96.4 85.29 3.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.859 0.362 . . . . 0.0 110.915 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -114.46 -37.1 4.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.889 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 61.74 -169.11 0.18 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.855 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 61.33 170.64 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 173.36 12.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.871 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.63 62.07 5.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.962 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.8 tp -169.24 98.03 0.35 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.852 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -164.27 136.67 4.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.976 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -171.06 -59.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.968 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -128.56 138.11 32.38 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.759 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.31 111.27 3.23 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.533 2.155 . . . . 0.0 112.462 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -77.58 -25.01 8.44 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.489 2.126 . . . . 0.0 112.302 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.86 -47.22 77.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.173 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.1 m -88.41 72.03 8.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.951 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -138.3 -56.86 0.65 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.702 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.0 tp -70.89 -17.76 62.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.11 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -49.05 -47.2 45.01 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.437 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.5 p -62.33 -9.31 7.74 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.407 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 4.7 m-85 -100.16 137.27 38.83 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.602 0.239 . . . . 0.0 110.504 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.462 ' C ' HD11 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -123.17 -96.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.708 -0.223 . . . . 0.0 111.555 -179.591 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.924 ' HA ' HD21 ' A' ' 97' ' ' LEU . 4.2 m -142.97 -34.03 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -83.27 -20.47 34.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.257 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.414 ' O ' ' CB ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -83.34 -38.19 22.39 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.924 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -73.3 -46.28 50.51 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.355 -179.392 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.595 ' H ' HD22 ' A' ' 97' ' ' LEU . 3.1 ttmt -60.86 -37.29 81.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.885 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.28 -24.22 27.82 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 61.6 tt0 -86.82 -43.7 12.29 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.202 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 1.057 HD22 HG21 ' A' ' 106' ' ' ILE . 2.8 mt -55.7 -47.48 76.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.151 0.501 . . . . 0.0 110.121 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -42.06 98.25 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.246 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -8.15 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.041 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.72 -15.32 18.54 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.9 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.75 51.36 2.88 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.972 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 1.057 HG21 HD22 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -133.43 88.6 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.925 0.393 . . . . 0.0 111.022 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 156.27 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.091 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.814 ' HB3' ' HB3' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -142.76 -105.74 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.829 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.11 33.05 1.01 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.735 0.302 . . . . 0.0 111.556 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.86 -35.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.238 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 11.2 t -111.82 -32.17 6.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.08 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.814 ' HB3' ' HB3' ' A' ' 108' ' ' PHE . . . -114.09 119.81 38.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.903 0.382 . . . . 0.0 111.262 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -112.9 -55.58 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.531 ' HD3' HG12 ' A' ' 94' ' ' VAL . 0.0 OUTLIER -166.25 -39.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.629 179.549 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.11 -22.27 33.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.939 0.399 . . . . 0.0 110.632 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.677 ' O ' HD13 ' A' ' 120' ' ' LEU . 2.1 mt-10 -85.96 -38.11 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.954 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -80.65 -21.18 41.64 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.342 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.954 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -84.52 -28.36 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.933 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.03 -34.1 19.32 Favored 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.385 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.677 HD13 ' O ' ' A' ' 116' ' ' GLU . 2.0 mp -55.4 -34.1 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.402 -179.193 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.543 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 8.8 m-85 -70.69 -29.35 65.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.73 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.906 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . . . -51.26 -61.24 4.31 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.821 -0.172 . . . . 0.0 111.255 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.906 ' HD3' ' HB3' ' A' ' 122' ' ' ALA . 71.9 Cg_exo -47.92 175.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.46 2.107 . . . . 0.0 112.371 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -129.69 -62.38 0.97 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.126 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -56.79 148.93 19.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.037 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -157.05 59.35 0.35 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.483 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.67 115.75 30.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.77 0.319 . . . . 0.0 110.987 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -139.2 37.76 2.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.954 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.24 101.62 8.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.894 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -74.81 -65.21 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.947 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.276 -0.869 . . . . 0.0 111.13 -179.978 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -31.89 73.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -152.06 59.1 0.85 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.745 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.2 ttp -83.05 111.24 18.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.128 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.61 141.59 45.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.87 22.39 1.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.639 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.76 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 13.6 t -126.58 129.6 48.87 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.048 0.451 . . . . 0.0 110.732 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.58 146.79 29.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.323 -179.575 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -89.04 124.65 34.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.676 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -110.37 153.6 12.1 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-O 121.322 0.582 . . . . 0.0 112.255 -178.06 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.2 p -138.68 123.73 22.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.197 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.892 ' CG1' HD13 ' A' ' 45' ' ' LEU . 35.6 m -93.37 108.87 21.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.966 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.408 ' O ' HG22 ' A' ' 52' ' ' VAL . 9.8 mt-30 -90.0 106.52 18.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.97 146.47 24.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.104 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -138.01 30.43 2.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.51 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.1 mp -95.95 -53.92 7.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.306 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -175.4 -175.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.203 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -111.75 46.92 1.08 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.923 0.392 . . . . 0.0 110.631 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.61 29.99 0.18 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.745 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -95.85 -35.99 11.28 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 120.874 0.369 . . . . 0.0 110.075 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.528 ' HA ' ' HA ' ' A' ' 27' ' ' PHE . 0.2 OUTLIER 57.75 -176.72 0.07 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.274 0.559 . . . . 0.0 112.264 177.595 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.81 -165.59 0.32 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.793 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.43 72.23 9.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.914 0.387 . . . . 0.0 111.202 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.84 13.16 60.99 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.8 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -107.48 -55.32 2.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.994 0.426 . . . . 0.0 110.744 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 t -114.83 148.83 37.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.825 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.528 ' HA ' ' HA ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -163.74 30.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.667 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 173.99 -171.64 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.394 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.546 HD13 ' C ' ' A' ' 29' ' ' LEU . 3.4 tm? -96.6 105.69 17.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.994 0.426 . . . . 0.0 110.407 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 160.44 -138.66 5.64 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.147 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.457 ' HB2' HG22 ' A' ' 11' ' ' VAL . 2.7 p30 -143.3 143.68 31.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 m-80 -122.41 145.75 47.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.052 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.31 145.31 26.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.469 0.652 . . . . 0.0 111.906 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.925 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -114.28 139.41 49.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.641 179.526 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.925 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -71.28 155.26 40.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.089 0.471 . . . . 0.0 110.612 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.76 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.23 114.37 9.23 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.327 0.584 . . . . 0.0 112.013 -178.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.689 HG22 ' HG3' ' A' ' 41' ' ' GLN . 0.8 OUTLIER -126.09 -171.66 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.232 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.676 ' N ' HG23 ' A' ' 37' ' ' VAL . 2.0 m -89.97 57.59 3.87 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' A' ' 41' ' ' GLN . 2.9 tt0 78.51 -16.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.413 ' HB3' HG21 ' A' ' 37' ' ' VAL . 0.3 OUTLIER -52.91 -21.51 4.39 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.344 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.689 ' HG3' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -79.96 -28.3 39.61 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.088 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HA ' HG21 ' A' ' 53' ' ' VAL . 3.5 tp -83.51 -31.78 26.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.018 0.437 . . . . 0.0 110.901 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.66 -29.07 22.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.02 -40.35 82.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.121 0.486 . . . . 0.0 109.986 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.983 HD12 HG23 ' A' ' 53' ' ' VAL . 49.0 mt -78.82 -39.58 35.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.782 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -28.04 67.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.031 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.32 -29.88 25.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.337 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.82 118.15 47.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.784 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -85.35 42.67 1.11 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.764 2.309 . . . . 0.0 112.765 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mtp85 -119.79 -38.78 2.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.741 0.305 . . . . 0.0 110.625 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.641 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -101.46 -179.11 3.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.179 179.233 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 13' ' ' GLN . 4.7 m -117.99 137.4 52.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.695 0.283 . . . . 0.0 111.626 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.983 HG23 HD12 ' A' ' 45' ' ' LEU . 4.0 p -125.96 113.1 32.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.094 0.474 . . . . 0.0 110.962 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.676 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.8 mt-30 -127.66 135.57 50.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.325 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.533 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.5 pp -88.56 113.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.491 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.47 104.58 9.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.674 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -120.62 94.25 4.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.836 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.03 33.73 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 170.95 157.71 13.47 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.549 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.6 m -110.01 133.81 52.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.869 0.366 . . . . 0.0 110.963 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -152.07 152.9 32.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.874 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.76 -62.27 0.97 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.9 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 113.33 59.16 0.41 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.55 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 172.97 90.96 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.659 -0.782 . . . . 0.0 112.464 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 60.36 33.65 20.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.826 0.346 . . . . 0.0 110.99 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.95 -139.47 10.44 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.518 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.54 98.05 4.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.77 0.319 . . . . 0.0 110.879 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.9 m -125.65 107.81 10.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.026 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -162.61 58.32 0.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.785 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.437 ' N ' ' HD2' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -179.63 -61.56 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.004 -179.906 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.437 ' HD2' ' N ' ' A' ' 70' ' ' GLU . 30.7 Cg_endo -63.62 -175.31 0.26 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.478 2.119 . . . . 0.0 112.351 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 62.3 75.76 0.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.014 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 146.53 -46.39 0.75 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.492 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.71 -177.68 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.876 0.37 . . . . 0.0 110.896 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -92.83 164.32 13.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.921 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.2 138.63 50.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -153.75 173.68 15.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.893 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.3 pttt -64.72 -179.1 0.47 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.906 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 -59.96 121.55 12.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.83 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.53 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -171.03 144.45 2.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.838 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.53 ' H ' HD13 ' A' ' 80' ' ' LEU . 18.5 mmm-85 61.8 43.34 9.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.93 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.19 167.06 19.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.042 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.421 ' N ' ' CD ' ' A' ' 84' ' ' PRO . 0.8 OUTLIER -86.78 -52.22 0.43 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.904 -179.99 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.424 ' HB3' ' CB ' ' A' ' 88' ' ' ASP . 25.9 Cg_exo -62.36 109.71 0.91 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.54 2.16 . . . . 0.0 112.295 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.34 141.67 23.14 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.521 2.147 . . . . 0.0 112.365 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t 58.56 49.93 9.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.919 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.5 p 58.65 160.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.989 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.435 ' O ' ' CE1' ' A' ' 92' ' ' PHE . 0.3 OUTLIER 179.89 -38.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 tp -107.69 -48.28 3.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.092 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -48.95 -42.77 38.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.464 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 35.3 m -61.89 -15.7 44.8 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.435 ' CE1' ' O ' ' A' ' 88' ' ' ASP . 32.4 m-85 -94.16 91.12 6.63 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 120.889 0.376 . . . . 0.0 110.227 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.3 p -65.09 -105.41 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.748 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.797 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 16.1 t -132.56 -56.48 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.876 0.369 . . . . 0.0 111.601 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.42 -19.78 66.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.113 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.17 -21.44 36.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.214 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -74.39 -58.68 3.14 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.797 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.3 ptpt -59.75 -29.83 68.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.667 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.53 -25.71 28.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.077 0.465 . . . . 0.0 111.75 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -86.73 -36.25 18.75 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.668 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.499 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 7.8 mt -58.54 -48.13 81.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.221 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.455 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -67.45 -38.49 84.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.965 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.97 -6.7 55.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.185 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.426 ' HG2' HD11 ' A' ' 106' ' ' ILE . 3.4 ttm-85 -102.79 -15.27 16.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.266 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.4 36.99 4.17 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.634 -0.794 . . . . 0.0 112.863 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.435 ' HB ' HD22 ' A' ' 101' ' ' LEU . 3.9 mp -141.56 91.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.72 0.295 . . . . 0.0 111.201 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.8 t -59.96 159.59 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.971 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.455 ' HE1' HG23 ' A' ' 102' ' ' THR . 1.8 p90 -150.14 72.82 1.13 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.691 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -66.02 -67.98 0.4 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.083 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -140.6 32.93 1.83 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -111.67 -34.3 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.877 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.632 ' HB1' ' HB3' ' A' ' 117' ' ' LEU . . . -119.84 85.5 2.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.891 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.475 ' O ' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.28 -85.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.114 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.731 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -140.44 -37.18 0.46 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.477 ' N ' ' HG2' ' A' ' 114' ' ' LYS . . . -83.18 -23.81 32.74 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.9 mt-10 -85.82 -36.88 19.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.357 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.922 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -80.09 -19.64 46.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.93 -179.655 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.922 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.59 -28.13 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.06 -33.56 19.48 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.998 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.514 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 5.6 tp -49.24 -41.03 36.2 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.085 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.499 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 20.9 m-85 -64.67 78.91 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.217 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.945 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . . . -167.1 -62.24 0.01 OUTLIER Pre-proline 0 CA--C 1.531 0.226 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.945 ' HD3' ' HB3' ' A' ' 122' ' ' ALA . 2.8 Cg_exo -76.23 65.16 7.13 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.543 2.162 . . . . 0.0 112.261 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -146.27 153.02 40.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.129 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.6 168.8 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -172.33 -105.68 0.19 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.486 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -172.04 151.63 2.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.883 0.373 . . . . 0.0 110.961 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -105.68 151.11 24.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.846 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 1.4 m -121.47 88.35 2.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.952 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -137.43 131.72 32.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.918 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.094 -179.936 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 112.446 -0.262 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.5 m 61.19 154.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.892 0.377 . . . . 0.0 110.997 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -140.3 -69.62 0.4 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.884 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 5.7 ttt -178.63 -39.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.865 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -59.29 97.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.008 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.3 tttp -139.17 -171.41 3.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.887 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -175.08 139.78 0.49 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.952 -179.847 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.487 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.05 143.26 30.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.404 0.621 . . . . 0.0 112.493 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.5 p -95.54 121.67 37.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.71 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.8 150.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.025 0.441 . . . . 0.0 111.228 -179.005 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.2 p -135.82 124.54 38.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.298 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.567 HG13 ' HG ' ' A' ' 45' ' ' LEU . 11.3 m -93.14 104.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.369 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.36 108.02 19.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.628 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.663 ' OD1' HD13 ' A' ' 16' ' ' ILE . 0.9 OUTLIER -127.24 146.52 50.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.189 -179.791 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.565 ' HA ' HD21 ' A' ' 29' ' ' LEU . 8.6 mtp180 -131.34 45.23 2.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.645 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.679 HG22 ' HG3' ' A' ' 17' ' ' LYS . 1.7 mp -93.65 -73.1 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.84 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.679 ' HG3' HG22 ' A' ' 16' ' ' ILE . 2.4 mtpm? -156.51 -173.96 4.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.781 0.324 . . . . 0.0 110.903 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -87.24 -31.22 20.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.92 0.39 . . . . 0.0 110.705 179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.11 46.83 1.11 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.299 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.536 ' CD1' HG21 ' A' ' 16' ' ' ILE . 2.1 t80 -91.44 11.37 24.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.735 0.302 . . . . 0.0 111.136 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 59.39 176.03 0.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.151 0.501 . . . . 0.0 111.613 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.404 ' HB2' ' CG ' ' A' ' 27' ' ' PHE . 2.8 tmm_? -177.75 -68.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.445 179.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.1 14.29 27.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.704 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 105.77 31.23 4.27 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.399 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -173.83 166.92 4.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.642 0.258 . . . . 0.0 110.594 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 p -59.14 101.93 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.831 0.348 . . . . 0.0 110.191 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.404 ' CG ' ' HB2' ' A' ' 22' ' ' ARG . 0.2 OUTLIER -83.73 9.28 12.15 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.896 -179.088 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.401 ' O ' ' CE1' ' A' ' 27' ' ' PHE . 45.3 m-70 63.2 168.23 0.14 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.935 0.398 . . . . 0.0 111.229 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.565 HD21 ' HA ' ' A' ' 15' ' ' ARG . 3.5 tm? -97.27 106.73 19.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.797 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 165.68 -150.83 18.91 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.443 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -119.39 133.49 55.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.828 0.347 . . . . 0.0 110.92 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.457 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 8.9 m120 -116.34 124.46 50.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.617 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.16 145.62 26.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.464 0.649 . . . . 0.0 111.464 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.966 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -113.41 139.9 48.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.331 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.966 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.29 157.58 37.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.161 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.887 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.46 111.44 5.32 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.761 0.791 . . . . 0.0 111.214 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.542 ' N ' HG22 ' A' ' 7' ' ' THR . 4.5 t -127.6 168.3 20.98 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.461 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.513 ' H ' HG12 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -52.75 -69.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.742 0.306 . . . . 0.0 111.367 179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -156.71 -16.6 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 87.6 p -42.47 -44.52 4.09 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.88 HE22 ' CG2' ' A' ' 55' ' ' ILE . 2.8 pp0? -55.72 -47.03 77.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.807 0.337 . . . . 0.0 111.721 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.456 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 6.7 tp -49.24 -55.41 12.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.469 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.87 -27.9 61.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.18 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -51.77 68.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.662 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.567 ' HG ' HG13 ' A' ' 12' ' ' VAL . 2.9 mm? -78.82 -44.19 23.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.875 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -63.05 -17.71 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.245 179.885 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.77 -67.72 0.25 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.85 0.357 . . . . 0.0 111.56 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.91 133.58 41.04 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -84.98 48.64 2.38 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.689 2.259 . . . . 0.0 112.566 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.67 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER -111.42 -38.43 4.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.85 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.708 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -112.96 -176.51 2.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.728 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 m -116.34 128.57 73.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.213 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.471 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 3.3 p -116.09 116.27 51.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.09 120.65 29.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.239 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.88 ' CG2' HE22 ' A' ' 41' ' ' GLN . 1.1 pt -88.36 139.26 17.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.24 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p -122.2 104.47 9.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.611 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -151.1 102.93 2.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.784 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.4 t -51.49 93.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.168 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -165.52 -178.11 38.34 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.486 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.5 m -161.4 165.14 29.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.828 0.347 . . . . 0.0 110.927 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -142.79 55.18 1.4 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.55 130.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.866 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -105.88 75.86 0.23 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.438 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.47 -125.27 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.447 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -104.3 -66.67 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.772 0.32 . . . . 0.0 110.936 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.28 -164.46 19.2 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.44 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.1 tp -116.97 -63.57 1.43 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.848 0.356 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 t 60.95 63.95 1.2 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.12 145.13 39.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.889 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -146.74 91.11 5.34 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.807 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -50.95 117.66 3.56 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.561 2.174 . . . . 0.0 112.403 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.61 128.27 56.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.115 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -131.69 -78.47 0.16 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.51 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.04 152.03 24.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.821 0.343 . . . . 0.0 110.884 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -105.7 -39.46 6.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.913 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.07 151.42 36.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.865 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.94 -39.93 2.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.111 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.12 -19.17 62.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.315 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 61.59 81.63 0.19 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.871 0.367 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -93.67 -35.8 12.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.867 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.18 159.27 44.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.927 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -98.77 146.22 26.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.031 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.63 136.13 95.98 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.912 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.67 149.85 34.57 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.5 2.133 . . . . 0.0 112.358 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -74.21 -168.26 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.481 2.121 . . . . 0.0 112.347 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.2 p 62.06 118.46 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.001 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -127.8 -176.21 3.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.844 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -159.0 -51.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.933 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.645 HD12 ' O ' ' A' ' 118' ' ' ILE . 2.5 mm? -95.63 -24.99 16.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.105 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -49.02 -45.81 43.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.512 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -13.91 31.2 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -106.17 144.8 32.36 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 110.71 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.413 ' O ' HD21 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -98.98 -104.67 0.21 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.974 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.555 ' HA ' HD11 ' A' ' 97' ' ' LEU . 2.9 m -144.86 -38.71 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.763 0.316 . . . . 0.0 111.17 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -82.11 -21.2 36.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.461 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.2 OUTLIER -70.28 -52.35 23.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.289 0.566 . . . . 0.0 109.754 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.693 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.81 -57.91 7.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.53 179.185 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.723 ' HE2' HD11 ' A' ' 117' ' ' LEU . 1.8 ttmt -54.3 -36.78 64.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.544 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.89 -22.19 29.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.944 0.402 . . . . 0.0 112.001 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.457 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -87.0 -39.1 15.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.275 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.572 HD23 ' CZ ' ' A' ' 121' ' ' PHE . 1.4 mt -59.68 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.165 0.507 . . . . 0.0 110.034 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.554 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -64.33 -40.03 95.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.35 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.49 -6.56 53.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.289 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -100.18 -15.24 18.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.158 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.3 28.86 9.36 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.481 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.0 mt -121.95 88.43 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.762 0.315 . . . . 0.0 111.038 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 72.8 p -58.46 140.38 54.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.554 ' HE1' HG23 ' A' ' 102' ' ' THR . 15.5 p90 -138.78 74.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.24 -71.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -122.27 28.04 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.07 -31.79 6.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.922 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.546 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -134.51 107.31 7.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -79.89 -80.15 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.072 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.641 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -141.74 -37.91 0.4 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.797 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.59 -21.16 38.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.877 0.37 . . . . 0.0 110.563 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 46.7 mm-40 -85.74 -38.85 17.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.705 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.735 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -79.89 -19.34 48.41 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.486 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.807 ' O ' HD13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -83.25 -27.73 7.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.823 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.78 -33.13 18.76 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.988 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.525 HD23 HD11 ' A' ' 101' ' ' LEU . 18.1 tp -49.05 -44.15 41.49 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.306 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CZ ' HD23 ' A' ' 101' ' ' LEU . 96.2 m-85 -68.26 70.77 0.17 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.296 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.986 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . . . -162.48 -64.01 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.986 ' HD3' ' HB3' ' A' ' 122' ' ' ALA . 16.7 Cg_exo -67.66 101.89 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.258 1.972 . . . . 0.0 112.126 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.88 85.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.009 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -150.16 -178.0 6.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.879 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -155.87 -141.24 3.16 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.547 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -116.05 -42.46 3.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.841 0.353 . . . . 0.0 110.884 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.61 -45.21 0.98 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.93 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.08 142.16 31.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.955 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -141.04 162.72 34.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.889 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.106 180.0 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.9 t 63.5 125.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.777 0.322 . . . . 0.0 110.977 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 -95.4 -67.51 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -178.27 -68.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.849 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -165.87 150.46 8.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.881 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.84 31.58 4.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.793 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -166.73 130.79 2.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.884 -179.986 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.535 ' CE2' HD13 ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.4 121.81 10.32 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.417 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.2 p -111.35 127.73 55.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 177.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 1.002 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.84 153.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.08 0.467 . . . . 0.0 111.613 -178.553 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.7 p -138.03 106.54 3.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.849 HG21 HD22 ' A' ' 45' ' ' LEU . 82.2 t -92.48 134.12 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.937 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.401 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 1.1 mt-30 -119.71 108.47 14.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.134 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.35 145.8 26.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.393 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.1 ttp-105 -131.48 34.98 3.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.913 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -104.58 -54.39 6.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.085 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -178.08 -174.12 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.846 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -97.84 27.5 4.42 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.864 0.364 . . . . 0.0 110.887 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.16 53.27 0.28 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.115 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.588 ' CD2' HD21 ' A' ' 51' ' ' LEU . 42.3 t80 -98.25 33.39 2.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.959 0.409 . . . . 0.0 111.052 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? 62.91 -169.62 0.19 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.609 178.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.533 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.2 OUTLIER 66.63 -173.96 0.19 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.633 179.687 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.751 ' HB2' ' CD2' ' A' ' 27' ' ' PHE . . . 75.41 2.42 3.83 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.739 -178.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.39 15.27 69.25 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.396 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.479 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -179.69 -49.17 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.667 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 p 168.9 93.71 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.802 0.334 . . . . 0.0 110.658 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.751 ' CD2' ' HB2' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -61.21 139.25 58.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.971 -179.861 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -86.62 -172.0 3.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.956 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.498 HD13 ' C ' ' A' ' 29' ' ' LEU . 2.7 tm? -99.49 107.65 19.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.659 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 156.29 -142.21 8.6 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.381 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.404 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -129.04 130.66 46.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.1 t-20 -122.87 128.02 49.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.589 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 61.4 m -87.26 145.44 26.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.131 0.491 . . . . 0.0 111.506 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.847 HD13 ' O ' ' A' ' 35' ' ' ALA . 2.7 tm? -102.9 153.73 19.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.674 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.847 ' O ' HD13 ' A' ' 34' ' ' LEU . . . -71.18 157.85 37.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 121.601 0.715 . . . . 0.0 112.805 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.793 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.69 104.85 2.97 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.551 0.691 . . . . 0.0 110.843 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.643 HG12 ' H ' ' A' ' 38' ' ' SER . 1.1 t -115.43 -159.45 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.947 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.643 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.9 m -107.74 40.82 1.64 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.725 0.297 . . . . 0.0 111.069 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.45 ' CB ' ' O ' ' A' ' 38' ' ' SER . 3.3 tt0 85.75 -18.58 0.35 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.226 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.0 m -50.44 -34.02 23.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.121 0.486 . . . . 0.0 110.323 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.49 ' NE2' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.32 -44.81 76.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.383 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.455 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -57.24 -55.48 34.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.871 -179.415 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.53 -27.13 63.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -56.87 -51.04 70.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.849 HD22 HG21 ' A' ' 12' ' ' VAL . 0.5 OUTLIER -78.71 -52.96 7.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.665 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.537 ' CA ' HG11 ' A' ' 53' ' ' VAL . 0.3 OUTLIER -53.88 -24.25 15.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.232 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.54 -29.71 1.91 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.437 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -117.85 117.79 35.31 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.763 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.05 68.44 5.8 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.455 2.104 . . . . 0.0 112.27 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mmt-85 -128.26 -43.82 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.101 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.588 HD21 ' CD2' ' A' ' 20' ' ' TYR . 56.6 mt -124.72 142.58 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.982 0.42 . . . . 0.0 111.143 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.29 111.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.348 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.537 HG11 ' CA ' ' A' ' 46' ' ' LYS . 1.4 p -98.56 118.19 44.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.127 0.489 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.77 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -121.9 144.79 48.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.397 -179.219 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 1.002 HG22 HG23 ' A' ' 10' ' ' VAL . 1.8 pp -107.41 144.76 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.231 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 m -122.22 104.58 9.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.602 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -97.91 89.92 4.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.878 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.6 p -56.58 99.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.047 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 173.01 -41.55 0.16 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.475 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.3 m -147.75 95.6 2.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.786 0.326 . . . . 0.0 110.911 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.85 132.12 47.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -146.88 143.48 28.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.939 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -84.74 -151.8 14.86 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.562 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -175.22 -116.49 0.45 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.475 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -162.86 -176.16 4.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.816 0.341 . . . . 0.0 110.979 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -81.17 -147.55 5.6 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.469 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.69 179.92 3.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.832 0.348 . . . . 0.0 110.915 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 3.6 p -163.83 108.92 1.04 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.9 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.5 ptmt -125.79 79.65 1.84 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.99 146.74 33.12 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.892 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.62 150.8 51.58 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.543 2.162 . . . . 0.0 112.295 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -91.13 130.74 36.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.102 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 111.21 163.64 18.03 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.527 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.1 p -116.54 117.67 30.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.912 0.387 . . . . 0.0 110.922 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -122.52 135.75 54.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.931 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -105.64 -31.61 8.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.929 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -68.22 -38.62 82.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.884 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.48 -178.41 4.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -116.13 177.32 4.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.953 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -141.4 74.02 1.44 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.82 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -109.74 -25.4 10.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.04 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 65.27 84.92 0.15 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.062 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -146.1 113.51 4.52 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.762 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.483 ' N ' ' CD ' ' A' ' 85' ' ' PRO . 48.0 Cg_exo -54.76 -45.19 42.83 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.458 2.106 . . . . 0.0 112.499 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 84' ' ' PRO . 36.2 Cg_exo -57.52 85.81 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.368 2.045 . . . . 0.0 112.129 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.43 112.16 19.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.004 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 30.0 m -82.94 -45.32 14.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.837 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 t70 70.53 -63.3 0.41 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.052 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 92' ' ' PHE . 47.6 tp -58.04 -19.53 32.18 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.52 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -49.04 -50.23 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.663 0.268 . . . . 0.0 111.408 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -1.3 9.82 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.505 ' HB2' HD12 ' A' ' 89' ' ' LEU . 2.4 m-85 -95.06 104.68 16.56 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.815 ' O ' HD21 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -123.79 -92.41 0.53 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.965 HG12 ' HZ1' ' A' ' 98' ' ' LYS . 2.0 t -125.5 -50.79 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-O 120.884 0.373 . . . . 0.0 111.773 -179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.34 -19.39 39.41 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.07 -25.97 29.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.828 HD13 ' N ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -81.77 -53.26 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.509 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.965 ' HZ1' HG12 ' A' ' 94' ' ' VAL . 4.7 ptpt -57.92 -29.74 65.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.116 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.71 -25.47 28.34 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 16.2 mt-30 -86.87 -32.83 20.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.459 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 9.4 mt -61.14 -48.87 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -38.08 86.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.968 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -75.46 -6.89 52.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.957 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -113.72 13.74 18.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.007 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 58.48 60.79 8.28 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.748 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.2 mt -144.78 96.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.679 0.276 . . . . 0.0 111.18 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.3 p -52.72 149.63 5.97 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.786 0.327 . . . . 0.0 111.105 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -72.66 -50.93 21.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.808 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.14 160.45 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.988 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.15 76.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -178.36 -39.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.656 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -82.59 59.31 4.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.007 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.5 -71.9 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.227 -179.806 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.67 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -153.62 -41.25 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.579 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.85 -22.62 36.88 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.043 0.449 . . . . 0.0 110.199 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 81.6 mm-40 -85.94 -38.07 18.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.62 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.982 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.05 -24.07 51.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.335 -179.12 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.982 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.29 -26.57 7.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.182 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.475 ' HB1' ' HB2' ' A' ' 123' ' ' PRO . . . -86.98 -35.16 19.0 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.239 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 14.3 tp -50.33 -46.65 55.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.894 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.505 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 20.5 m-85 -47.81 -70.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.947 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . . . -103.46 -65.86 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.947 ' HD3' ' HB3' ' A' ' 122' ' ' ALA . 85.8 Cg_exo -45.85 154.48 0.69 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.344 2.029 . . . . 0.0 112.786 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -177.18 -177.19 0.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.067 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -102.78 39.7 1.49 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.831 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -93.14 155.01 22.14 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.452 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -171.25 36.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 110.937 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -176.34 149.49 0.84 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.912 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 1.3 m -136.4 31.38 2.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.912 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -149.94 163.34 38.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.846 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.095 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.474 -0.25 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.2 t -142.38 86.46 1.96 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.74 0.305 . . . . 0.0 110.925 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -131.37 -32.05 1.58 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.421 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.5 tpt 74.82 153.16 0.14 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.9 0.381 . . . . 0.0 110.754 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -88.14 -176.44 5.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.234 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.69 -40.19 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.628 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.895 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -114.26 141.45 47.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.392 179.714 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.484 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.01 145.91 31.7 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.276 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.9 p -96.18 126.43 41.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.685 HG11 HD12 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -109.89 150.68 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.109 0.481 . . . . 0.0 111.369 -178.872 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.4 p -136.98 131.14 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.682 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.001 HG13 HD13 ' A' ' 45' ' ' LEU . 6.7 m -98.39 104.59 16.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.436 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 0.1 OUTLIER -104.6 106.71 17.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.814 179.854 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.754 HD21 HG13 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -130.27 146.48 51.88 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.086 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.47 84.42 2.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.145 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.3 mt -126.3 -61.71 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.762 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -142.34 -83.08 0.19 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.517 0.199 . . . . 0.0 111.218 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 162.88 -16.97 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.915 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.78 46.44 1.08 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.835 -0.697 . . . . 0.0 111.944 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.456 ' HB3' HD11 ' A' ' 29' ' ' LEU . 2.9 t80 -101.66 27.6 6.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.914 0.388 . . . . 0.0 111.072 -179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' PHE . 7.2 mmt180 59.85 -177.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.409 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.773 ' NH1' HG11 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -171.23 -82.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.487 179.384 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -93.94 -43.01 8.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.365 0.602 . . . . 0.0 110.581 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 171.45 39.41 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.862 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.493 ' CE1' ' HB2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -165.02 -160.17 0.48 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.315 -0.443 . . . . 0.0 110.215 -179.171 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.45 78.97 1.91 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.725 0.298 . . . . 0.0 111.27 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.493 ' HB2' ' CE1' ' A' ' 25' ' ' PHE . 6.3 t80 -78.73 151.05 32.32 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.578 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.463 ' O ' ' N ' ' A' ' 30' ' ' GLY . 13.1 m170 -92.67 36.73 1.01 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.914 0.388 . . . . 0.0 110.274 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.506 HD23 ' HB3' ' A' ' 14' ' ' ASN . 7.9 mp 47.81 -86.14 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.34 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 28' ' ' HIS . . . 38.07 -136.48 0.92 Allowed Glycine 0 C--N 1.337 0.637 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.924 179.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.45 116.69 13.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.865 0.364 . . . . 0.0 111.043 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.568 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 42.4 t-20 -119.46 127.59 53.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.208 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.97 145.21 26.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.427 0.632 . . . . 0.0 111.576 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.913 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.15 141.8 44.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.841 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.913 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.69 156.72 39.12 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 120.998 0.428 . . . . 0.0 110.575 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.27 114.26 8.24 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.357 0.599 . . . . 0.0 111.32 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.695 HG23 ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -131.82 -170.81 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.936 -179.49 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.695 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -66.67 -71.43 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -160.57 -18.15 0.05 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.6 p -42.85 -38.3 2.12 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.74 0.305 . . . . 0.0 111.813 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.709 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -58.56 -42.1 87.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.755 -179.735 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.55 HD13 HG23 ' A' ' 55' ' ' ILE . 5.4 tp -71.54 -30.3 65.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.415 -179.118 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.494 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -89.32 -27.97 20.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.588 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -69.82 -46.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.89 0.376 . . . . 0.0 110.637 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 1.001 HD13 HG13 ' A' ' 12' ' ' VAL . 65.7 mt -78.91 -31.57 45.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.176 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.52 ' HB2' HG11 ' A' ' 53' ' ' VAL . 13.1 tttt -83.29 -15.7 49.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.298 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.494 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -48.51 -39.46 23.35 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.683 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -121.01 142.63 35.13 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -84.12 50.7 3.15 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.723 2.282 . . . . 0.0 112.522 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.832 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -97.79 -49.69 4.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.536 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.832 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -125.26 -171.22 2.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.938 179.3 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.754 HG13 HD21 ' A' ' 14' ' ' ASN . 2.6 m -110.71 143.14 21.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 111.927 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.52 HG11 ' HB2' ' A' ' 46' ' ' LYS . 3.2 p -131.43 117.6 36.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.192 178.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.578 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -127.46 135.06 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.068 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.591 HG22 HE22 ' A' ' 41' ' ' GLN . 1.0 OUTLIER -88.63 120.35 37.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.843 179.231 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 70.8 p -122.19 104.6 9.57 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.875 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -69.04 -63.41 1.07 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.885 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.1 p -103.31 132.15 49.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.86 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 170.15 -37.04 0.18 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.542 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.1 p -132.47 137.8 47.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.819 0.342 . . . . 0.0 110.857 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.99 164.29 12.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.889 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.3 177.21 8.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.855 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -143.66 -130.22 2.36 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.5 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -144.76 -88.83 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.459 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.75 -177.18 5.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.779 0.323 . . . . 0.0 110.857 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.534 ' O ' HD22 ' A' ' 67' ' ' LEU . . . -142.46 105.99 0.43 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.533 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.534 HD22 ' O ' ' A' ' 66' ' ' GLY . 3.4 mm? -125.26 30.6 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.797 0.332 . . . . 0.0 110.873 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -142.07 122.83 14.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.836 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp -77.05 99.33 5.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.871 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -173.79 91.56 0.35 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.926 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.9 103.7 0.9 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.528 2.152 . . . . 0.0 112.349 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -132.47 -46.1 0.9 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.102 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -170.3 -155.3 10.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.468 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.1 m 60.71 -178.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 110.892 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -108.11 162.3 14.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.869 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.6 179.72 5.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.834 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.99 96.0 3.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.851 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt 60.44 24.82 14.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.06 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 62.99 127.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.988 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mt -103.81 136.71 42.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -173.02 39.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.823 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -135.11 28.47 3.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.359 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.452 ' CB ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -90.67 -52.33 0.31 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.949 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.452 ' HD3' ' CB ' ' A' ' 83' ' ' ASP . 4.2 Cg_exo -77.16 113.72 3.65 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.849 2.366 . . . . 0.0 112.009 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -51.37 92.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.319 2.013 . . . . 0.0 112.3 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 59.6 p -129.41 157.02 43.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.043 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.6 t -178.81 131.1 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.867 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -150.33 -178.17 6.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.973 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.75 HD11 ' O ' ' A' ' 118' ' ' ILE . 18.6 tp -120.84 -50.74 2.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.881 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -48.84 -30.39 5.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.741 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 t -62.05 -13.1 22.85 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.584 ' HB3' HD23 ' A' ' 97' ' ' LEU . 22.1 m-85 -108.06 159.87 16.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.633 0.254 . . . . 0.0 110.738 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.621 HG22 HG23 ' A' ' 94' ' ' VAL . 65.2 m -118.38 -97.86 0.46 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.609 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.726 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.2 t -139.05 -52.91 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.059 0 CA-C-O 121.198 0.523 . . . . 0.0 111.347 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -72.74 -19.85 61.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.8 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -80.68 -36.41 32.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 120.852 0.358 . . . . 0.0 110.893 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.726 HD11 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -63.32 -58.35 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.317 0.58 . . . . 0.0 109.981 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.622 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 3.3 ptpt -55.06 -33.59 62.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.335 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.74 -22.01 29.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.066 0.46 . . . . 0.0 111.443 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.571 ' NE2' ' CE1' ' A' ' 92' ' ' PHE . 7.7 mt-30 -87.09 -36.8 17.93 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.907 HD21 HD12 ' A' ' 120' ' ' LEU . 9.0 mt -59.45 -48.68 80.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.199 0.523 . . . . 0.0 110.148 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -37.52 83.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.596 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.14 -6.57 59.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.265 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 -100.12 -15.22 18.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.169 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.55 -2.89 21.8 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.006 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.472 ' HB ' HD22 ' A' ' 101' ' ' LEU . 2.9 mt -109.93 78.38 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.909 0.385 . . . . 0.0 111.113 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.445 HG23 ' O ' ' A' ' 107' ' ' THR . 3.5 t -82.17 90.99 6.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.501 ' HE2' HD12 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.04 -177.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.107 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 9.9 mttm -148.46 -51.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.58 30.25 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.894 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -116.72 -37.48 3.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.497 ' HB3' ' HD2' ' A' ' 108' ' ' PHE . . . -100.99 99.86 10.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.886 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -80.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.241 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.677 ' HA ' HD22 ' A' ' 117' ' ' LEU . 8.3 ptmt -143.01 -38.9 0.34 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.734 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.05 -23.13 38.77 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -85.81 -36.86 19.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.755 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.953 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.0 -22.67 39.24 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.371 -179.419 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.953 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.41 -28.14 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.073 178.644 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.61 -33.17 18.94 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 121.209 0.528 . . . . 0.0 110.826 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.907 HD12 HD21 ' A' ' 101' ' ' LEU . 1.4 tm? -49.12 -51.21 33.32 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.692 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.538 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 40.8 m-85 -58.1 82.61 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.703 0.287 . . . . 0.0 110.982 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -148.35 160.31 37.06 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.233 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.68 -42.32 69.57 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.609 2.206 . . . . 0.0 112.157 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -172.47 112.07 0.26 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.203 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -107.18 32.94 4.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.965 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 83.23 -158.51 36.21 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.451 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 60.73 87.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.868 0.366 . . . . 0.0 110.784 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -95.52 74.4 3.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.022 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 3.1 m -111.06 178.0 4.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.795 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 59.58 30.16 19.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.949 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.254 -0.879 . . . . 0.0 111.034 179.932 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.4 t 60.72 36.53 19.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.846 0.355 . . . . 0.0 110.89 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -105.22 -178.01 3.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.961 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.15 -73.3 0.66 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.937 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.94 178.7 5.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.959 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.3 102.32 3.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.976 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.78 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -141.92 154.18 44.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.554 179.79 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.515 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -144.79 143.53 30.7 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.569 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -89.36 125.12 35.0 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.873 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.731 ' CG1' HD12 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -110.31 149.11 13.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.364 0.602 . . . . 0.0 112.011 -178.395 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.5 p -138.6 126.67 28.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.452 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.051 HG13 HD13 ' A' ' 45' ' ' LEU . 16.9 m -93.82 104.69 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.549 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.88 106.56 18.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.427 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.594 ' ND2' HD13 ' A' ' 16' ' ' ILE . 1.8 t30 -105.15 146.45 29.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.07 0.462 . . . . 0.0 111.09 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 mtm180 -135.87 32.05 2.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.205 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.842 HG22 ' CG ' ' A' ' 17' ' ' LYS . 5.0 mp -97.92 -58.26 3.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.23 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.842 ' CG ' HG22 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -168.87 -170.1 1.11 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.801 0.334 . . . . 0.0 110.935 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.431 ' HB2' ' CD2' ' A' ' 28' ' ' HIS . 4.7 pt-20 -109.11 -16.05 14.19 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.137 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.5 44.03 1.59 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.131 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.448 ' CD1' ' HD2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -94.0 -1.72 54.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.576 0.226 . . . . 0.0 111.275 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 60.6 -175.46 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.026 0.441 . . . . 0.0 111.29 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.567 ' NH1' HD23 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -173.92 -162.84 0.15 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.616 179.564 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.485 ' HB3' ' HE1' ' A' ' 25' ' ' PHE . . . -44.76 -30.03 0.88 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.991 0.424 . . . . 0.0 111.375 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 147.24 39.95 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.314 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.485 ' HE1' ' HB3' ' A' ' 23' ' ' ALA . 4.3 m-85 -135.98 23.84 3.31 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.485 0.18 . . . . 0.0 111.485 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 43.72 61.18 2.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.947 0.404 . . . . 0.0 111.123 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CE2' ' HB2' ' A' ' 14' ' ' ASN . 3.4 t80 -56.97 112.6 1.38 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.159 -179.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.431 ' CD2' ' HB2' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -82.22 -172.33 3.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.774 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.546 HD13 ' C ' ' A' ' 29' ' ' LEU . 2.3 tm? -80.57 102.81 10.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.16 0.505 . . . . 0.0 110.177 179.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.19 -139.88 6.23 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.205 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.495 ' HB2' HG22 ' A' ' 11' ' ' VAL . 37.3 p-10 -143.08 143.93 32.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.921 0.391 . . . . 0.0 111.297 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.8 m-20 -119.16 137.86 53.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.079 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.19 145.08 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.359 0.599 . . . . 0.0 111.484 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.894 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -115.07 143.4 45.25 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.93 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.894 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.33 157.38 37.84 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 121.179 0.514 . . . . 0.0 111.044 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.78 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.56 111.34 5.32 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.686 0.755 . . . . 0.0 111.987 -177.46 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.726 HG12 ' H ' ' A' ' 38' ' ' SER . 2.3 t -129.93 179.67 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.489 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.726 ' H ' HG12 ' A' ' 37' ' ' VAL . 0.6 OUTLIER -104.79 72.61 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -179.127 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 78.52 -16.65 0.65 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 178.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 t -62.58 -21.37 65.56 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.577 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -84.61 -25.77 28.35 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.376 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.539 HD12 HG22 ' A' ' 53' ' ' VAL . 7.5 tp -74.36 -54.72 7.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.96 0.41 . . . . 0.0 110.977 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.63 -21.48 66.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.184 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -48.38 21.61 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 1.051 HD13 HG13 ' A' ' 12' ' ' VAL . 59.1 mt -78.83 -30.75 45.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.284 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.452 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -77.28 -10.26 59.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.373 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.69 -47.94 29.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.794 0.331 . . . . 0.0 111.44 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.5 123.08 64.8 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -80.6 55.28 5.61 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.579 2.186 . . . . 0.0 112.455 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.432 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -135.58 -43.07 0.68 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 -179.925 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.704 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -90.97 -176.5 4.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.52 108.83 19.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.775 0.321 . . . . 0.0 111.599 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.539 HG22 HD12 ' A' ' 42' ' ' LEU . 1.8 p -98.93 111.77 29.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.195 0.521 . . . . 0.0 110.295 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.629 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.7 mt-30 -127.04 144.66 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.295 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.492 HG22 HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -100.03 133.13 44.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.353 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m -122.4 104.66 9.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.782 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -91.86 -64.73 1.08 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.3 m -67.69 -55.87 11.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.95 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 131.72 93.55 0.59 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.1 t -91.21 161.27 15.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.77 0.319 . . . . 0.0 110.967 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -150.7 -46.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.898 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -158.73 179.86 8.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.858 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -149.3 -68.87 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.523 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.56 27.97 71.76 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.535 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.88 79.28 0.47 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.855 0.359 . . . . 0.0 110.899 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.18 159.22 32.29 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.467 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.52 -31.58 72.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 110.914 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.45 87.77 0.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.962 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -128.84 6.75 5.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.415 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 59.82 159.5 0.1 Allowed Pre-proline 0 C--N 1.332 -0.162 0 CA-C-O 120.792 0.329 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.95 125.76 19.79 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.568 2.179 . . . . 0.0 112.285 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -168.0 -48.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.106 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -103.27 76.15 0.29 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.482 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.7 m -96.72 42.91 1.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.78 0.324 . . . . 0.0 110.861 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.39 103.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.825 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.5 109.24 10.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.879 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -111.05 126.17 54.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.931 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -155.07 82.98 1.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -86.84 104.79 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.023 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.57 ' O ' HD12 ' A' ' 80' ' ' LEU . 3.0 pp -176.33 126.45 0.19 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -99.26 152.66 19.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.927 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.79 157.3 19.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.121 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.412 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -178.51 -61.54 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.886 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.412 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 59.6 Cg_endo -72.45 109.97 2.87 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.528 2.152 . . . . 0.0 112.347 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.16 174.76 8.52 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.427 2.085 . . . . 0.0 112.309 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.2 m -155.61 126.82 7.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.937 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.61 -71.81 0.2 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.901 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -174.07 -49.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.964 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER -116.86 -33.94 4.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.971 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -48.82 -41.79 34.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.341 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.87 -13.78 27.68 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.439 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 6.2 m-85 -106.29 104.53 14.25 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 66.5 p -89.44 -85.54 0.2 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.997 -178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.712 ' HA ' HD22 ' A' ' 97' ' ' LEU . 24.2 t -145.5 -56.52 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.957 0.408 . . . . 0.0 111.309 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -73.44 -19.25 61.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.005 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -81.99 -20.8 37.76 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.734 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.712 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -78.5 -58.27 3.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.656 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.4 ptpt -55.34 -29.66 58.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.345 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.81 -30.32 24.65 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.064 0.459 . . . . 0.0 112.022 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 121' ' ' PHE . 3.9 mm-40 -86.5 -22.02 26.64 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.696 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.796 HD13 ' CD1' ' A' ' 106' ' ' ILE . 1.2 mt -76.87 -42.2 40.81 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.333 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.405 ' HA ' ' CG2' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -64.29 -43.39 94.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.377 179.686 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -6.33 53.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.176 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.469 ' HG2' ' O ' ' A' ' 104' ' ' ARG . 0.7 OUTLIER -108.56 -15.46 14.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.153 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.669 ' O ' HG22 ' A' ' 106' ' ' ILE . . . 144.25 -54.6 0.57 Allowed Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.179 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.951 HD11 ' CD2' ' A' ' 108' ' ' PHE . 9.4 tp 52.27 136.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-O 121.457 0.646 . . . . 0.0 112.725 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 18.1 p -156.36 26.68 0.35 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.545 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.951 ' CD2' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.82 87.52 0.14 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.644 -179.535 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -67.14 70.9 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 51.28 27.3 3.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.6 p -117.43 -29.23 5.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.268 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.752 ' HB3' ' CB ' ' A' ' 108' ' ' PHE . . . -85.22 76.05 10.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.81 0.338 . . . . 0.0 111.386 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -70.59 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.983 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.795 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.1 mttp -154.09 -42.24 0.09 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.73 0.3 . . . . 0.0 111.477 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.29 -23.9 40.39 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.926 0.393 . . . . 0.0 110.143 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.8 mt-10 -85.97 -37.37 19.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.452 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.88 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -77.88 -19.82 54.1 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.913 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.88 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -82.85 -27.85 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.997 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.3 -34.74 18.77 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.84 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.461 ' O ' ' N ' ' A' ' 122' ' ' ALA . 1.2 tp -49.9 -40.43 42.97 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.447 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.526 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 6.0 m-85 -51.58 86.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.287 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -117.25 140.22 26.95 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.132 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.41 121.81 10.13 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.416 2.077 . . . . 0.0 112.352 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -120.03 -62.8 1.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.105 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -85.09 176.97 8.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.901 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -66.25 -168.58 2.85 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.536 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -102.5 149.61 24.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.74 0.305 . . . . 0.0 110.926 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.55 136.65 32.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.997 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 12.1 t -131.96 -47.08 0.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -126.69 -56.68 1.37 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.859 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.211 -0.899 . . . . 0.0 111.096 179.967 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m 60.45 -176.31 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.886 0.374 . . . . 0.0 110.881 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -142.5 127.72 18.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.956 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.1 ptt? -101.8 31.6 3.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.851 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -163.6 -173.72 3.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.829 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.27 40.56 17.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.842 HG22 ' C ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -162.51 132.05 4.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.646 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.504 ' O ' ' HD1' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.23 144.67 30.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.366 0.603 . . . . 0.0 112.619 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.69 130.06 36.02 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.638 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.737 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.24 152.61 12.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 112.079 -178.557 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.5 p -138.47 102.1 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.316 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.847 HG21 HD13 ' A' ' 45' ' ' LEU . 42.9 t -92.49 130.25 41.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.18 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 28.3 tt0 -125.0 106.62 10.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.866 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -96.64 146.57 24.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.694 179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.488 ' H ' HD12 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -124.74 38.4 4.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.234 0.54 . . . . 0.0 110.142 179.151 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.69 ' N ' HD21 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -146.83 139.41 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.315 -179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.863 ' O ' HD23 ' A' ' 29' ' ' LEU . 0.0 OUTLIER 50.43 -163.86 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.135 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -96.44 63.63 2.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.557 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.424 ' HA3' ' C ' ' A' ' 27' ' ' PHE . . . 93.84 -34.82 4.44 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.027 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 77.48 39.97 0.17 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.821 0.343 . . . . 0.0 111.004 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 60.24 -175.84 0.11 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.434 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.441 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -172.88 -162.65 0.18 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.822 179.566 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.27 -19.3 13.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.47 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 150.08 -12.56 0.95 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.567 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -77.09 -6.04 51.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.658 0.266 . . . . 0.0 111.198 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.41 ' O ' ' CE1' ' A' ' 28' ' ' HIS . 0.6 OUTLIER 62.49 73.81 0.45 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.039 0.447 . . . . 0.0 110.845 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.441 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 4.4 t80 -55.94 157.45 4.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.594 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.41 ' CE1' ' O ' ' A' ' 26' ' ' SER . 65.4 m80 -129.63 167.62 17.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.814 0.34 . . . . 0.0 110.977 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.863 HD23 ' O ' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -67.55 103.57 1.38 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.252 0.549 . . . . 0.0 110.477 179.252 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.436 ' O ' ' HA ' ' A' ' 13' ' ' GLN . . . 170.76 -140.51 6.01 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.108 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -138.9 131.63 29.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.768 0.318 . . . . 0.0 111.02 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.43 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 10.1 m-20 -126.38 131.78 51.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.236 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.4 m -87.22 145.76 26.26 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.167 0.508 . . . . 0.0 111.162 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.946 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -115.34 141.16 48.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.118 -179.847 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.946 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.67 157.3 38.23 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.9 0.381 . . . . 0.0 110.219 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.842 ' C ' HG22 ' A' ' 7' ' ' THR . . . -69.2 114.58 7.59 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.742 0.782 . . . . 0.0 111.352 -177.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 38' ' ' SER . 11.1 t -127.79 167.91 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.775 -179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.542 ' N ' HG12 ' A' ' 37' ' ' VAL . 0.3 OUTLIER -53.39 -53.71 47.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.595 -179.93 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.74 -20.62 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.38 -33.1 0.6 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.825 0.345 . . . . 0.0 111.473 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.616 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.1 -57.85 11.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.771 179.618 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.44 HD13 HG23 ' A' ' 55' ' ' ILE . 8.8 tp -53.05 -55.47 23.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.874 -178.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -67.33 -30.94 70.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -53.08 -54.62 32.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.364 . . . . 0.0 110.661 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.847 HD13 HG21 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -79.07 -54.45 5.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.062 179.783 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.652 ' N ' HG11 ' A' ' 53' ' ' VAL . 11.7 tttt -49.26 -25.94 2.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.511 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -45.19 -30.2 1.13 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.541 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -112.5 121.73 38.17 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.774 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -77.19 69.58 7.05 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.468 2.112 . . . . 0.0 112.266 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.35 -40.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.173 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.711 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -100.22 124.45 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.754 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.501 ' O ' HG13 ' A' ' 12' ' ' VAL . 3.5 t -69.7 106.11 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.999 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.652 HG11 ' N ' ' A' ' 46' ' ' LYS . 2.0 p -107.13 117.73 53.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.703 178.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.727 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.07 142.96 51.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.084 -178.665 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.526 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.2 pt -93.8 126.78 46.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.28 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t -122.28 104.59 9.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.59 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.558 ' O ' HG22 ' A' ' 58' ' ' THR . 2.5 pm0 -84.54 -59.64 2.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.574 -179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 57' ' ' GLU . 12.8 t 47.25 -171.26 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.79 0.329 . . . . 0.0 111.298 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -114.12 141.47 17.0 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.667 -0.777 . . . . 0.0 112.57 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.4 m -71.53 95.24 1.38 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.869 0.366 . . . . 0.0 110.927 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -114.01 -37.34 4.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.866 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -92.96 140.26 29.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.89 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -98.01 146.46 18.22 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.493 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -131.52 154.24 20.8 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.517 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -133.46 30.79 3.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.851 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 170.54 171.03 35.51 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.425 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.61 -61.36 1.39 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.801 0.334 . . . . 0.0 110.859 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -175.63 -55.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.04 143.54 23.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -57.88 109.42 1.78 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.988 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.65 135.73 24.44 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.516 2.144 . . . . 0.0 112.312 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.91 -63.81 1.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.069 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -155.05 -162.77 11.49 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.451 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.85 -34.05 34.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.783 0.325 . . . . 0.0 110.87 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -174.8 -41.01 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -156.02 98.56 1.9 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.911 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -140.5 -177.19 4.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.26 175.5 6.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.954 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -107.63 -159.26 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.71 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.6 mt 66.02 41.75 3.53 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.808 0.337 . . . . 0.0 110.969 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.1 mtm-85 62.69 132.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.085 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -98.75 -30.79 12.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.025 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -92.46 112.64 56.39 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.848 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.482 ' N ' ' CD ' ' A' ' 85' ' ' PRO . 44.1 Cg_exo -55.33 -45.08 42.81 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.372 2.048 . . . . 0.0 112.564 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' A' ' 84' ' ' PRO . 47.2 Cg_exo -56.11 123.24 13.35 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.362 2.041 . . . . 0.0 112.188 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 21.3 t -161.97 85.76 0.61 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.935 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.4 m -145.09 87.79 1.85 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 62.04 34.99 16.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.026 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 1.017 HD21 ' HB3' ' A' ' 122' ' ' ALA . 3.0 mm? -110.09 -27.11 9.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.058 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -54.62 -50.28 68.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.332 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.8 m -62.41 -14.63 42.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.48 ' HB3' HD11 ' A' ' 118' ' ' ILE . 4.3 m-85 -71.75 -14.45 62.01 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 122.24 -0.287 . . . . 0.0 111.26 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.757 ' O ' HD11 ' A' ' 97' ' ' LEU . 0.2 OUTLIER 57.74 -148.72 0.48 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.968 179.293 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.689 ' O ' HD22 ' A' ' 97' ' ' LEU . 4.0 m -127.44 -32.08 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.166 0.508 . . . . 0.0 110.993 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.6 -19.55 38.18 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.441 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -23.6 40.13 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.823 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 1.01 HD13 ' H ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.78 -48.92 8.91 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.18 179.8 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HE3' ' CD2' ' A' ' 117' ' ' LEU . 0.8 OUTLIER -57.89 -35.67 71.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.611 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.16 -23.97 28.15 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.501 ' HG2' ' CE1' ' A' ' 121' ' ' PHE . 1.0 OUTLIER -86.52 -37.89 17.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.664 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.795 HD12 ' CD1' ' A' ' 117' ' ' LEU . 1.9 mt -59.34 -46.98 87.13 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.479 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -59.93 -43.08 95.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.961 179.297 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -72.62 -6.78 46.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.051 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -105.98 -15.43 14.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.87 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 63.05 63.85 4.25 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.725 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.668 ' HB ' HD22 ' A' ' 101' ' ' LEU . 48.5 mm -116.59 -86.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.587 0.194 . . . . 0.0 111.109 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.657 HG22 HG22 ' A' ' 106' ' ' ILE . 1.3 t 169.88 150.13 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.479 ' CZ ' HG23 ' A' ' 102' ' ' THR . 13.4 p90 -171.89 92.27 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.971 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -176.79 135.4 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.883 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 68.84 -67.11 0.22 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.873 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.3 p -65.88 -68.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.71 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.562 ' O ' HG23 ' A' ' 113' ' ' THR . . . -79.98 179.56 7.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.965 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.562 HG23 ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -172.34 -80.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.749 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.407 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -138.21 -57.49 0.65 Allowed 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.422 179.676 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.71 -35.03 79.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.148 0.499 . . . . 0.0 109.954 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -86.84 -33.95 19.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.756 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.795 ' CD1' HD12 ' A' ' 101' ' ' LEU . 1.7 tp -74.67 -37.47 62.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.896 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.703 ' O ' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -77.56 -28.31 15.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.101 179.651 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.75 -32.5 20.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 121.077 0.465 . . . . 0.0 110.872 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.7 mt -54.98 -40.36 69.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.641 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.56 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.4 m-85 -51.5 -41.08 60.71 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.676 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 1.017 ' HB3' HD21 ' A' ' 89' ' ' LEU . . . -129.78 85.94 56.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.427 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.25 -27.61 7.92 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.599 2.199 . . . . 0.0 112.077 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -169.87 -42.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.956 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.554 ' OD1' ' HB2' ' A' ' 131' ' ' ALA . 0.6 OUTLIER 61.21 44.6 9.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.989 179.816 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 75.04 -171.53 53.86 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.542 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.41 100.03 5.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.829 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.5 tttt 60.87 176.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.869 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 3.0 t 68.93 -67.28 0.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.959 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -101.44 153.51 19.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.907 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.554 ' HB2' ' OD1' ' A' ' 125' ' ' ASP . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.205 -0.903 . . . . 0.0 111.145 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.28 103.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.825 0.345 . . . . 0.0 110.857 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -139.47 -47.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 36.9 mmt -104.95 -30.58 9.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.917 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -79.3 155.77 28.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.099 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -149.65 83.79 1.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.884 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.867 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -139.09 139.49 37.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.785 -179.839 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.536 ' CZ ' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -145.07 137.12 25.77 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.7 p -87.91 124.41 33.65 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.801 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.02 157.72 10.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 CA-C-O 120.923 0.392 . . . . 0.0 111.385 -178.625 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.4 p -138.51 108.97 4.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.112 0.482 . . . . 0.0 110.537 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.961 HG22 HD13 ' A' ' 45' ' ' LEU . 2.5 t -92.68 135.9 26.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.23 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -116.72 113.34 22.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.757 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.522 ' HB3' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -96.59 137.38 35.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.039 0.447 . . . . 0.0 110.951 -179.952 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -135.72 29.74 3.18 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.215 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.829 HG22 ' HG2' ' A' ' 17' ' ' LYS . 3.3 mp -107.08 -60.05 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.389 -179.681 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.829 ' HG2' HG22 ' A' ' 16' ' ' ILE . 1.6 mmmm -148.38 -175.49 4.93 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.739 0.304 . . . . 0.0 110.911 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -109.81 0.68 18.9 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.984 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -141.78 44.81 0.98 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.827 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.558 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 4.8 t80 -86.96 56.84 4.19 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.063 0.458 . . . . 0.0 110.264 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 41.58 110.48 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.893 -1.048 . . . . 0.0 112.856 179.074 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.579 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -58.5 -156.06 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.215 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . 79.12 28.93 0.37 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.983 0.421 . . . . 0.0 110.41 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 102.81 34.31 4.1 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.521 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.467 ' HB2' ' O ' ' A' ' 21' ' ' ARG . 56.3 m-85 -155.84 -70.93 0.11 Allowed 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.522 ' HB2' ' C ' ' A' ' 20' ' ' TYR . 38.4 t -54.37 -94.23 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.619 0.247 . . . . 0.0 111.326 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 55.15 26.03 7.86 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.721 0.296 . . . . 0.0 110.954 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.52 176.84 0.14 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.63 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HA ' HD23 ' A' ' 29' ' ' LEU . 15.7 mt -82.35 101.02 10.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.163 0.506 . . . . 0.0 110.831 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 175.05 -141.03 5.58 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.178 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -128.58 127.01 41.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.773 0.321 . . . . 0.0 110.961 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.407 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.5 p30 -114.73 123.39 49.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.848 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -87.44 145.73 26.15 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.331 0.586 . . . . 0.0 111.629 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.951 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.5 OUTLIER -114.91 139.08 50.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.945 179.671 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.951 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.8 156.4 39.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.867 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.63 116.73 11.29 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.415 0.626 . . . . 0.0 111.384 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.66 HG23 ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -130.19 -171.69 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.849 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.66 ' N ' HG23 ' A' ' 37' ' ' VAL . 44.3 p -59.77 -58.63 7.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.172 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 179.88 -16.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.4 t -42.54 -34.76 0.91 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.821 HE22 HG22 ' A' ' 55' ' ' ILE . 2.4 pp0? -58.9 -48.75 80.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.843 0.354 . . . . 0.0 111.356 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.526 HD13 HG21 ' A' ' 55' ' ' ILE . 9.3 tp -55.55 -50.11 70.91 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.406 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -77.25 -29.67 54.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.444 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -58.59 -46.57 86.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.119 0.485 . . . . 0.0 110.15 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.961 HD13 HG22 ' A' ' 12' ' ' VAL . 4.5 mt -78.95 -48.15 15.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.704 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.418 ' CA ' HG11 ' A' ' 53' ' ' VAL . 1.5 ttmm -64.12 -16.72 62.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.291 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.53 -41.94 14.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.807 0.337 . . . . 0.0 111.462 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.422 ' HB2' ' CE1' ' A' ' 25' ' ' PHE . 0.6 OUTLIER -101.83 121.37 51.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.84 179.895 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.54 62.6 6.33 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.57 2.18 . . . . 0.0 112.3 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.78 -46.14 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 14' ' ' ASN . 44.6 mt -92.26 144.49 25.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.993 0.425 . . . . 0.0 111.187 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.69 108.18 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.935 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.623 HG23 HD12 ' A' ' 45' ' ' LEU . 1.3 p -104.66 121.39 56.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.971 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.705 ' O ' HG22 ' A' ' 10' ' ' VAL . 9.0 pm0 -126.92 133.39 50.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.635 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.821 HG22 HE22 ' A' ' 41' ' ' GLN . 1.1 pt -97.98 131.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.446 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.3 m -122.38 104.53 9.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.459 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -84.76 -79.32 0.22 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.104 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.77 113.14 16.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.961 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -107.37 40.09 2.65 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.407 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 26.1 m 61.02 76.21 0.38 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.789 0.328 . . . . 0.0 110.944 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -176.01 116.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.826 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.13 129.99 45.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 92.22 -148.37 19.13 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.53 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -148.91 48.23 0.61 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.466 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -64.08 152.91 39.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.806 0.336 . . . . 0.0 110.905 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 119.27 -56.68 0.57 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.419 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.3 mt -92.8 124.93 37.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 110.906 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.9 p -101.89 157.0 17.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.88 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.94 -49.11 6.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.869 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.25 152.36 84.83 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.912 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.67 128.93 16.82 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.59 2.193 . . . . 0.0 112.327 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -144.46 -57.58 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.101 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 67.04 99.95 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.508 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.72 124.1 20.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.8 0.334 . . . . 0.0 110.921 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -106.34 69.5 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -159.48 107.32 1.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -115.68 161.97 17.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.878 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -157.27 -46.82 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.93 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.95 164.82 11.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.817 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.443 HD23 ' N ' ' A' ' 80' ' ' LEU . 2.3 pt? -158.44 32.34 0.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.926 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.23 70.76 0.1 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.9 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.89 105.46 0.32 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.158 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -161.31 87.8 1.63 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.854 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -51.65 139.32 48.3 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.479 2.119 . . . . 0.0 112.277 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -73.65 157.46 48.4 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.448 2.099 . . . . 0.0 112.321 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.494 ' O ' HG22 ' A' ' 87' ' ' THR . 4.8 p -77.52 141.77 39.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.908 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.494 HG22 ' O ' ' A' ' 86' ' ' SER . 15.0 t 45.41 -167.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.319 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.52 ' O ' HG22 ' A' ' 91' ' ' THR . 0.4 OUTLIER 68.45 -69.0 0.16 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.943 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.473 HD12 HD11 ' A' ' 118' ' ' ILE . 4.1 mm? -63.34 -16.91 61.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.203 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -49.06 -50.29 37.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.393 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.52 HG22 ' O ' ' A' ' 88' ' ' ASP . 1.4 t -62.19 -15.08 44.09 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -114.22 103.5 11.16 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.697 0.284 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.445 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -94.55 -80.87 0.4 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.593 -179.579 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.753 ' HA ' HD22 ' A' ' 97' ' ' LEU . 28.1 t -147.33 -56.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.81 0.338 . . . . 0.0 111.302 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -19.59 60.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.981 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -82.65 -21.28 35.05 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.514 -179.362 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.753 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -75.6 -58.47 3.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -57.12 -29.13 63.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.29 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.9 23.95 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 7.3 mm-40 -84.17 -28.01 27.67 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.216 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.944 HD22 ' HA ' ' A' ' 106' ' ' ILE . 1.1 mt -69.78 -45.73 67.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.849 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.489 ' HA ' ' HB ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -57.33 -45.29 84.4 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.373 179.541 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -75.52 -6.32 49.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.413 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -114.76 24.17 12.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.599 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.61 -32.09 6.87 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.743 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.944 ' HA ' HD22 ' A' ' 101' ' ' LEU . 0.5 OUTLIER 43.9 96.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 112.106 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -118.16 28.23 8.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.512 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.917 ' CE2' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -69.34 -177.74 1.21 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.096 -179.79 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.43 165.91 12.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.96 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -26.12 42.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.943 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -82.58 0.89 40.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.387 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.82 77.53 0.08 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.785 0.326 . . . . 0.0 111.005 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 70.5 p -77.05 -79.75 0.11 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.979 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.722 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.1 pptp? -146.55 -39.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.667 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.412 ' HA ' HG22 ' A' ' 118' ' ' ILE . . . -80.82 -23.75 38.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.94 0.4 . . . . 0.0 110.714 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -85.92 -37.2 19.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.502 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.891 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.65 -19.33 41.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.947 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.891 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.48 -26.27 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.101 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.52 -34.31 20.04 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.819 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.98 -41.57 64.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.077 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.493 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 4.6 m-85 -48.21 -59.22 3.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.42 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.407 ' HB1' ' HD2' ' A' ' 123' ' ' PRO . . . 61.39 163.42 0.11 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.089 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.407 ' HD2' ' HB1' ' A' ' 122' ' ' ALA . 50.5 Cg_exo -55.59 167.76 1.92 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.596 2.197 . . . . 0.0 112.441 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -169.13 136.99 1.9 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.006 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -107.07 -67.51 0.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.082 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -145.63 -143.94 4.03 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.591 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -125.78 151.68 46.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.819 0.342 . . . . 0.0 110.944 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -168.43 -46.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.823 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.45 -39.05 3.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.875 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.09 107.44 5.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.878 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.132 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.811 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 6.3 t . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.739 0.304 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.82 152.99 38.59 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -98.88 122.93 42.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.727 HG11 HD12 ' A' ' 45' ' ' LEU . 0.4 OUTLIER -110.22 155.63 11.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.007 0.432 . . . . 0.0 111.873 -178.47 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -135.71 134.91 51.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.113 0.482 . . . . 0.0 111.201 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.811 HG13 HD13 ' A' ' 45' ' ' LEU . 14.1 m -102.36 107.52 22.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.039 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.72 106.46 18.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.563 ' CG ' HD12 ' A' ' 51' ' ' LEU . 53.8 t30 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.371 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.872 0.368 . . . . 0.0 111.01 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.557 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.7 t-20 -116.36 130.53 56.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.1 m -86.96 145.14 26.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.455 0.645 . . . . 0.0 111.625 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.942 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.41 142.14 44.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.865 179.717 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.942 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.34 157.56 37.53 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.11 0.481 . . . . 0.0 110.773 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.811 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -69.2 105.15 2.4 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.764 0.792 . . . . 0.0 111.095 -177.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 35' ' ' ALA . 5.6 t -123.66 166.48 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.047 0 CA-C-N 114.205 -1.362 . . . . 0.0 110.617 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.491 ' N ' HG12 ' A' ' 37' ' ' VAL . 11.3 t -52.09 -73.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.351 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -156.5 -16.69 0.1 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -43.03 -45.88 5.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.879 0.371 . . . . 0.0 111.408 -179.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.627 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -44.24 -60.92 1.69 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.204 179.562 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD13 HG23 ' A' ' 55' ' ' ILE . 11.4 tp -52.01 -55.38 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.784 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -35.07 79.08 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' SER . 2.6 tp60 -68.2 -41.8 80.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.852 0.358 . . . . 0.0 111.061 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.811 HD13 HG13 ' A' ' 12' ' ' VAL . 68.2 mt -78.74 -31.24 46.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.61 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -79.64 -29.8 41.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 110.865 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.53 -29.7 59.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.185 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -93.19 110.15 44.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.764 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.85 58.78 6.62 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.514 2.143 . . . . 0.0 112.418 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.59 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER -140.97 -45.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.59 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.2 OUTLIER -107.75 175.35 5.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.545 179.796 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.604 ' O ' HG12 ' A' ' 12' ' ' VAL . 2.9 m -110.67 146.04 16.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.96 0.41 . . . . 0.0 111.984 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.457 HG21 ' HA ' ' A' ' 42' ' ' LEU . 3.2 p -130.82 116.32 33.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.818 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.644 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.0 mm-40 -127.47 131.43 50.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.48 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.633 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.8 pt -88.75 132.3 33.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.586 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 39.1 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.489 179.518 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.5 tp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.898 0.38 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -44.09 41.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.556 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.88 -14.87 38.01 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -93.66 104.19 16.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.825 0.345 . . . . 0.0 110.521 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.523 HG22 HG23 ' A' ' 94' ' ' VAL . 68.0 m -79.94 -97.61 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.458 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.623 ' HA ' HD11 ' A' ' 97' ' ' LEU . 20.5 t -142.89 -41.85 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.942 0.401 . . . . 0.0 111.246 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -77.77 -20.88 52.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.618 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.89 -51.01 24.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.221 0.534 . . . . 0.0 109.912 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.657 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -50.86 -58.3 6.32 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.904 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.554 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 3.4 ptpt -56.87 -33.31 66.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.727 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.1 -24.15 28.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.982 0.42 . . . . 0.0 112.004 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.478 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 1.3 tp60 -87.09 -37.8 17.08 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.589 HD11 HD22 ' A' ' 120' ' ' LEU . 1.2 mt -60.07 -46.94 87.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.033 0.444 . . . . 0.0 110.081 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -39.83 90.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.179 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.12 -6.58 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.125 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -101.75 -15.34 17.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.14 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.29 39.2 3.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.58 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.443 ' HB ' HD22 ' A' ' 101' ' ' LEU . 29.6 mt -141.58 85.08 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.762 0.315 . . . . 0.0 111.169 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.6 t -62.08 157.92 17.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.823 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.0 p90 -152.39 101.13 2.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.971 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.51 -52.49 2.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.823 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -83.16 -59.1 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.767 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.1 t -88.08 -167.83 2.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.717 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.823 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . 54.65 48.71 19.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.031 0.444 . . . . 0.0 111.087 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.32 -70.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.657 ' HE3' ' HB2' ' A' ' 115' ' ' ALA . 0.0 OUTLIER -157.53 -39.87 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.328 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.657 ' HB2' ' HE3' ' A' ' 114' ' ' LYS . . . -83.12 -21.47 33.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.003 0.43 . . . . 0.0 109.993 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 9.5 mm-40 -85.84 -38.79 17.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.658 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.804 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -78.06 -20.14 52.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.611 -0.435 . . . . 0.0 111.524 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.804 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -28.0 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.779 177.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.58 -31.81 19.66 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.18 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.589 HD22 HD11 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -49.05 -53.11 21.71 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.147 -178.751 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.556 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 88.5 m-85 . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 111.416 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.902 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 2.0 t . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 120.523 0.202 . . . . 0.0 110.813 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.56 ' CE2' ' HB ' ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.52 145.61 30.22 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.0 p -123.56 121.19 35.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.944 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.874 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.75 152.43 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 111.915 -178.532 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.6 p -127.43 137.31 58.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.68 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.749 ' CG1' HD13 ' A' ' 45' ' ' LEU . 15.7 m -110.78 104.65 17.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -90.66 106.33 18.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.748 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 121.026 0.441 . . . . 0.0 111.535 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.434 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.893 0.377 . . . . 0.0 111.329 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.503 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 2.3 t-20 -124.06 138.27 54.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.08 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.07 145.05 26.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.361 0.601 . . . . 0.0 111.511 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.959 HD22 ' H ' ' A' ' 35' ' ' ALA . 1.6 tm? -101.29 150.91 22.5 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.643 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.959 ' H ' HD22 ' A' ' 34' ' ' LEU . . . -70.73 156.64 39.25 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 121.742 0.782 . . . . 0.0 112.828 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.902 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.18 105.02 3.26 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.924 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.703 ' O ' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -123.46 -170.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.955 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.613 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.8 p -85.66 43.01 1.0 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.809 ' OE1' HD23 ' A' ' 42' ' ' LEU . 0.0 OUTLIER 79.23 -16.51 0.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.069 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -44.85 -34.15 2.23 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.125 0.488 . . . . 0.0 110.586 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.582 ' OE1' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -56.99 -44.24 82.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.258 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.809 HD23 ' OE1' ' A' ' 39' ' ' GLU . 13.9 tp -56.46 -55.63 31.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.147 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -26.18 55.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.557 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -49.4 75.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.821 0.343 . . . . 0.0 110.594 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.77 HD12 HG11 ' A' ' 10' ' ' VAL . 11.4 mt -79.06 -46.55 17.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.545 ' CA ' HG11 ' A' ' 53' ' ' VAL . 1.7 tttp -54.93 -22.56 15.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.346 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.01 -70.77 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.639 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -64.07 117.2 33.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.858 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -80.57 87.27 1.53 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.509 2.14 . . . . 0.0 112.546 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -168.15 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.917 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.627 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -93.87 174.85 6.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.505 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -115.91 106.86 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.279 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.545 HG11 ' CA ' ' A' ' 46' ' ' LYS . 2.1 p -99.02 115.71 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.54 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.656 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.8 tp60 -108.77 130.36 55.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.823 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.874 HG22 HG23 ' A' ' 10' ' ' VAL . 1.3 pp -107.64 105.48 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.721 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.761 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.905 HD21 HG12 ' A' ' 118' ' ' ILE . 18.9 tp . . . . . 0 CA--C 1.527 0.087 0 CA-C-O 120.765 0.317 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -49.04 -47.6 44.55 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.532 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.08 -13.06 22.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.691 ' HB2' HD12 ' A' ' 89' ' ' LEU . 42.9 m-85 -94.66 -20.9 19.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 120.644 0.259 . . . . 0.0 111.18 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.772 ' O ' HD21 ' A' ' 97' ' ' LEU . 1.6 p 61.13 -147.92 0.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.953 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.684 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.5 t -120.34 -54.92 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.073 0 CA-C-O 121.012 0.434 . . . . 0.0 111.512 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -65.08 -19.96 66.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.971 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.7 OUTLIER -76.33 -37.88 56.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 120.774 0.321 . . . . 0.0 110.784 -178.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 1.006 HD11 HD12 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -64.04 -58.5 6.49 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.766 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HD2' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -54.23 -35.07 62.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.976 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.03 -23.66 28.51 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.43 ' O ' ' N ' ' A' ' 104' ' ' ARG . 6.2 mm-40 -86.78 -39.96 15.44 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.666 HD13 HG21 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -55.94 -48.78 75.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.194 0.521 . . . . 0.0 109.945 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.553 HG23 ' CD1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -64.03 -40.59 96.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.422 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -80.38 -6.35 57.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.433 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.495 ' HB3' HD13 ' A' ' 106' ' ' ILE . 5.0 ttt180 -97.87 -15.45 20.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.307 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 108.62 15.08 14.15 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.274 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.666 HG21 HD13 ' A' ' 101' ' ' LEU . 2.8 mp -96.3 -30.88 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.111 0.456 . . . . 0.0 110.758 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.7 p 47.29 28.54 1.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.614 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.553 ' CD1' HG23 ' A' ' 102' ' ' THR . 1.1 m-85 60.62 -174.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.525 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.47 ' N ' ' HB3' ' A' ' 112' ' ' ALA . 4.9 mmtp -177.46 173.82 1.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.889 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -31.06 60.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.82 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.32 -29.94 14.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.643 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.47 ' HB3' ' N ' ' A' ' 109' ' ' LYS . . . -80.99 58.82 3.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.06 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -70.69 -66.51 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.445 ' HA ' HD21 ' A' ' 117' ' ' LEU . 10.4 ptpp? -159.0 -45.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.61 -21.64 59.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.912 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 64.1 mm-40 -85.16 -37.52 20.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.997 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.91 HD12 ' N ' ' A' ' 118' ' ' ILE . 4.0 pp -71.23 -38.03 71.98 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.001 0.429 . . . . 0.0 110.382 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 1.006 HD12 HD11 ' A' ' 97' ' ' LEU . 1.7 tt -70.03 -26.56 30.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.121 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.92 -33.47 19.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.077 0.465 . . . . 0.0 111.173 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.16 -36.0 82.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.839 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 5.8 m-85 . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.913 0.387 . . . . 0.0 111.277 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.744 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 6.4 t . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.867 0.365 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.524 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.87 153.66 39.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.546 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 18.6 p -92.38 124.86 36.74 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.655 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 154.25 11.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.044 0.449 . . . . 0.0 111.334 -178.591 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.796 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.26 128.56 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 121.095 0.474 . . . . 0.0 112.035 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.017 HG13 HD13 ' A' ' 45' ' ' LEU . 1.7 m -96.92 104.53 15.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.773 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -107.96 106.58 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.621 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 m120 . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.938 179.924 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 121.186 0.517 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.796 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 t-20 -122.05 127.89 50.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.473 -0.785 . . . . 0.0 108.926 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 p -86.43 145.46 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.718 0.771 . . . . 0.0 112.653 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.915 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -122.09 141.33 51.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.149 179.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.915 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -71.16 155.92 40.18 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.141 0.496 . . . . 0.0 110.923 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.744 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.13 109.88 5.47 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.418 0.627 . . . . 0.0 111.838 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 38' ' ' SER . 0.7 OUTLIER -129.13 179.42 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.809 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.65 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.6 OUTLIER -51.22 -83.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.303 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.448 ' HA ' ' NE2' ' A' ' 41' ' ' GLN . 3.9 tt0 -148.02 -16.57 0.35 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.52 -47.31 5.1 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.626 ' HG3' HG22 ' A' ' 37' ' ' VAL . 1.2 pp0? -52.23 -27.69 15.75 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.44 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.3 tp -81.81 -39.8 23.48 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.843 0.354 . . . . 0.0 110.846 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -83.3 -21.46 33.23 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.422 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -70.5 -49.96 42.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 110.563 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 1.017 HD13 HG13 ' A' ' 12' ' ' VAL . 35.5 mt -78.79 -36.64 42.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.947 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.555 ' N ' HG11 ' A' ' 53' ' ' VAL . 7.4 tttm -67.37 -28.57 68.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.863 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -48.79 -28.3 3.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.228 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -101.97 104.41 35.75 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.761 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.78 66.43 4.86 Favored 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.486 2.124 . . . . 0.0 112.246 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.548 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -145.48 -39.1 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.309 -179.753 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.732 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -102.83 -167.29 1.37 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.669 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.13 106.75 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.908 0.385 . . . . 0.0 111.883 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.555 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.6 p -103.21 111.74 34.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.12 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.641 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.27 144.85 50.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.528 -179.034 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.655 HG22 HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -103.9 128.56 57.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.181 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 62.4 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.772 179.938 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.7 tp . . . . . 0 N--CA 1.463 0.211 0 CA-C-O 120.695 0.284 . . . . 0.0 111.421 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -49.05 -49.49 41.1 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.801 0.334 . . . . 0.0 111.256 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -13.87 32.61 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HB3' ' CD1' ' A' ' 118' ' ' ILE . 2.5 m-85 -79.23 139.31 37.95 Favored 'General case' 0 C--O 1.231 0.127 0 O-C-N 122.196 -0.315 . . . . 0.0 110.604 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -127.93 -70.21 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.221 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.572 ' HA ' HD11 ' A' ' 97' ' ' LEU . 39.9 t -153.27 -44.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.004 0.431 . . . . 0.0 111.405 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -20.69 38.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.642 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -76.1 -45.01 36.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 -179.334 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.835 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -59.32 -59.61 5.18 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.396 0.617 . . . . 0.0 110.27 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.491 ' HE3' HD21 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -58.29 -30.74 66.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.02 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.66 -21.4 30.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.598 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.452 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 0.0 OUTLIER -85.0 -37.55 20.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.579 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.572 ' HG ' ' CZ ' ' A' ' 121' ' ' PHE . 5.0 mt -64.57 -45.49 86.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 109.573 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.401 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.6 OUTLIER -63.59 -40.34 96.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.857 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -77.31 -6.73 54.31 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.249 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -102.01 -15.22 16.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.024 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 77.91 61.42 2.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.376 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 106' ' ' ILE . 6.3 tt -151.66 93.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.785 0.326 . . . . 0.0 111.142 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.01 140.93 6.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.068 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.571 ' CD1' ' N ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -121.9 -86.41 0.65 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.779 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 51.84 103.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.802 0.334 . . . . 0.0 111.346 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 64.04 178.22 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.411 . . . . 0.0 111.009 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . 0.533 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 2.4 m 56.46 23.01 7.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.037 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 111' ' ' SER . . . 168.14 75.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.04 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.75 -81.55 0.05 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.731 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.727 ' O ' HG22 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -131.88 -57.47 0.98 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.57 74.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 0.0 110.737 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -86.18 -33.54 20.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.359 0.599 . . . . 0.0 110.369 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.638 ' CD2' HD13 ' A' ' 97' ' ' LEU . 7.8 tp -78.09 -21.54 50.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.994 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.835 ' HA ' HD22 ' A' ' 97' ' ' LEU . 2.4 tp -82.77 -29.66 8.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.55 -31.02 21.46 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.71 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 tp -49.23 -45.1 44.1 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.07 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CZ ' ' HG ' ' A' ' 101' ' ' LEU . 48.8 m-85 . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.368 . . . . 0.0 110.953 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.895 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.675 0.274 . . . . 0.0 110.659 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.06 145.24 31.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.322 0.582 . . . . 0.0 112.535 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 14.5 p -92.75 126.52 37.87 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.95 153.59 11.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.459 -178.503 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.1 p -138.51 126.9 29.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 0.0 111.623 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.77 HG13 HD13 ' A' ' 45' ' ' LEU . 7.7 m -95.74 104.44 15.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.289 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -99.52 106.56 18.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 t30 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.815 -179.687 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.463 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 3.5 p-10 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.919 0.39 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.503 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 13.6 t-20 -122.24 133.83 54.7 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.054 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.6 m -87.1 145.42 26.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 111.63 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.914 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.84 142.18 44.53 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.998 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.914 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.4 157.58 37.53 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.33 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.23 113.05 6.22 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.688 0.756 . . . . 0.0 111.155 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.611 HG12 ' H ' ' A' ' 38' ' ' SER . 2.8 t -129.28 171.71 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.708 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.611 ' H ' HG12 ' A' ' 37' ' ' VAL . 42.7 m -56.38 -72.55 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.16 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.5 -16.67 0.11 Allowed 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 p -46.21 -41.09 12.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.72 -28.56 63.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 46' ' ' LYS . 10.6 tp -78.45 -50.59 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.0 110.8 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.53 -22.35 59.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.496 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -66.85 -44.56 80.71 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.934 0.397 . . . . 0.0 110.371 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.851 HD12 HG23 ' A' ' 53' ' ' VAL . 18.0 mt -78.88 -54.08 6.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.379 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 2.5 mttp -45.59 -28.75 1.02 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.469 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.82 -27.51 5.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.305 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.57 94.13 48.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.5 -21.27 18.08 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.733 2.289 . . . . 0.0 112.712 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.581 ' C ' HD13 ' A' ' 51' ' ' LEU . 9.1 ttm180 -47.65 -39.7 17.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.49 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.754 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -107.28 -165.22 1.04 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.519 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.59 140.75 48.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.747 0.308 . . . . 0.0 111.514 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.851 HG23 HD12 ' A' ' 45' ' ' LEU . 3.3 p -132.22 116.81 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.896 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.529 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.5 mt-30 -127.63 133.19 49.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.653 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.477 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -93.93 130.67 42.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.966 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.0 p . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.785 179.861 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 118' ' ' ILE . 4.2 mm? . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.826 0.346 . . . . 0.0 110.941 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -48.74 -35.87 15.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.698 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -62.23 -12.59 21.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.552 ' HB3' HD23 ' A' ' 97' ' ' LEU . 8.0 m-85 -80.73 -8.04 59.54 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.256 -0.278 . . . . 0.0 111.346 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.87 -162.17 0.19 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.779 0.323 . . . . 0.0 111.079 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.597 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.9 t -115.78 -42.72 3.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.21 0.529 . . . . 0.0 110.947 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -78.21 -19.71 53.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.121 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -27.53 54.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.0 110.675 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.757 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -76.35 -59.08 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.506 ' CE ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -47.38 -34.93 7.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.741 177.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.94 -21.71 29.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.021 0.439 . . . . 0.0 111.737 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.438 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 4.1 mm-40 -86.65 -38.59 16.91 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.566 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.611 HD23 ' CZ ' ' A' ' 121' ' ' PHE . 3.2 mt -59.84 -48.07 83.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.118 0.485 . . . . 0.0 109.964 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.568 HG23 ' CE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -65.44 -39.03 91.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -6.57 58.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.3 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.494 ' HD3' HD11 ' A' ' 106' ' ' ILE . 2.1 ttt85 -100.12 -15.57 18.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.308 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 98.72 38.9 3.77 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.339 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.494 HD11 ' HD3' ' A' ' 104' ' ' ARG . 4.2 mp -110.32 -22.01 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.793 0.296 . . . . 0.0 111.045 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 106' ' ' ILE . 14.7 t 45.51 28.34 0.49 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.794 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.568 ' CE1' HG23 ' A' ' 102' ' ' THR . 90.2 m-85 51.24 -160.23 0.09 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.108 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.8 pttt 45.52 93.13 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.064 0.459 . . . . 0.0 111.322 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 179.0 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.618 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 179.18 42.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.765 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.713 ' HB1' ' HB2' ' A' ' 117' ' ' LEU . . . -145.22 147.67 32.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.201 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.419 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 52.5 p -139.72 -80.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.4 tttm -145.38 -57.12 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.74 0.305 . . . . 0.0 110.74 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.0 -22.18 33.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.088 0.471 . . . . 0.0 109.884 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -86.2 -38.22 17.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 179.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.713 ' HB2' ' HB1' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -74.5 -36.82 63.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.181 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.849 HD13 ' O ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -62.67 -28.54 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.402 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.27 -33.0 19.41 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.918 0.39 . . . . 0.0 111.559 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.43 -53.02 62.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.611 ' CZ ' HD23 ' A' ' 101' ' ' LEU . 24.8 m-85 . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 120.939 0.399 . . . . 0.0 111.75 -178.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.757 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 8.0 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.834 0.35 . . . . 0.0 110.586 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -146.92 148.06 31.4 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.9 m -96.18 115.01 26.76 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.839 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -110.17 151.39 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-O 120.895 0.378 . . . . 0.0 111.59 -178.711 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.743 HG23 ' C ' ' A' ' 32' ' ' ASN . 7.6 p -137.4 131.7 44.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.538 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.849 HG13 HD13 ' A' ' 45' ' ' LEU . 29.3 m -93.06 104.75 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.287 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.402 ' HA ' ' HB3' ' A' ' 31' ' ' ASP . 0.6 OUTLIER -86.53 106.68 17.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.705 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.649 ' CG ' HD12 ' A' ' 51' ' ' LEU . 6.8 t30 . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.53 ' HB2' HG22 ' A' ' 11' ' ' VAL . 34.1 p-10 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.963 0.411 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.743 ' C ' HG23 ' A' ' 11' ' ' VAL . 2.0 t-20 -113.88 125.08 53.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.061 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.0 145.43 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.434 0.635 . . . . 0.0 111.685 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.939 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -112.09 138.95 48.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.816 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.939 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.45 156.68 39.04 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.279 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.757 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.46 108.4 4.26 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 111.426 -178.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.679 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -128.21 -176.51 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.186 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.679 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -48.82 -68.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.472 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.16 -17.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.5 t -42.42 -37.66 1.65 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.793 0.33 . . . . 0.0 111.687 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.686 ' HG2' HD11 ' A' ' 34' ' ' LEU . 2.3 pp0? -53.62 -50.46 65.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.456 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.683 HD13 ' CG2' ' A' ' 55' ' ' ILE . 5.7 tp -58.32 -46.47 86.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.091 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.87 -33.09 68.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.301 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -44.31 93.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.943 0.402 . . . . 0.0 110.279 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.849 HD13 HG13 ' A' ' 12' ' ' VAL . 21.9 mt -78.74 -33.63 46.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.885 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.4 mttt -71.17 -22.58 62.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.132 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.09 -61.83 1.7 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.574 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.03 124.51 53.94 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.69 56.89 6.24 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.576 2.184 . . . . 0.0 112.418 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.563 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -111.69 -39.36 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.944 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.688 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -111.86 -173.1 2.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.446 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.668 ' O ' HG23 ' A' ' 52' ' ' VAL . 16.2 m -119.44 106.26 18.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.835 0.35 . . . . 0.0 111.881 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.469 HG23 HD12 ' A' ' 45' ' ' LEU . 2.5 p -99.87 106.19 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.172 0.51 . . . . 0.0 110.757 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.455 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -127.33 127.89 45.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.107 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.839 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.13 130.35 37.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.05 0.452 . . . . 0.0 111.455 -179.824 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.9 p . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.559 179.656 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.5 HD11 ' O ' ' A' ' 118' ' ' ILE . 1.7 mm? . . . . . 0 CA--C 1.529 0.145 0 CA-C-O 120.54 0.21 . . . . 0.0 111.386 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -48.62 -49.44 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.7 0.286 . . . . 0.0 111.221 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -10.1 10.3 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 3.7 m-85 -104.9 127.45 52.73 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.691 0.281 . . . . 0.0 110.655 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.499 ' O ' HG21 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -116.3 -87.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.06 -179.729 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.789 ' HA ' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -151.83 -37.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-O 120.972 0.415 . . . . 0.0 111.047 179.855 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.63 -19.66 35.05 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.869 0.366 . . . . 0.0 110.99 178.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -77.91 -43.1 31.03 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.246 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.966 HD23 HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -64.8 -55.84 17.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.868 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.465 ' CD ' ' O ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -50.89 -31.95 19.08 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.0 178.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.06 -25.26 27.71 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.122 0.487 . . . . 0.0 111.537 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 1.7 mt-30 -86.88 -43.59 12.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.888 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.776 HD22 HG21 ' A' ' 106' ' ' ILE . 8.8 mt -54.74 -46.75 74.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.465 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -39.07 88.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.855 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -15.85 63.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.652 ' HD3' HD23 ' A' ' 101' ' ' LEU . 8.7 ptm180 -107.96 -15.23 14.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.047 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.59 83.9 0.47 Allowed Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.826 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.776 HG21 HD22 ' A' ' 101' ' ' LEU . 14.6 tt -125.84 -39.46 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.69 0.281 . . . . 0.0 111.524 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.1 m 71.58 87.8 0.11 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.647 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -116.0 124.89 51.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.997 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -176.98 37.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -170.8 30.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.341 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 84.2 p 178.78 -76.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.749 0.309 . . . . 0.0 110.922 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 117' ' ' LEU . . . -64.08 81.02 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.734 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -72.4 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.364 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.776 ' O ' HG23 ' A' ' 118' ' ' ILE . 0.3 OUTLIER -146.05 -57.44 0.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.491 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.28 67.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 11.8 mm-40 -85.91 -37.1 19.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.886 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.966 HD21 HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -69.15 -40.85 77.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.828 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.776 HG23 ' O ' ' A' ' 114' ' ' LYS . 0.9 OUTLIER -70.6 -30.5 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.476 ' N ' HG13 ' A' ' 118' ' ' ILE . . . -86.16 -31.83 21.6 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.34 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 1.1 mp -54.52 -42.75 71.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.323 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.511 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 1.9 m-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.601 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.776 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 12.5 t . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.962 0.41 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -146.79 145.28 29.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.24 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.6 p -94.45 133.4 38.08 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.762 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.43 155.86 11.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 121.039 0.447 . . . . 0.0 111.569 -179.093 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.3 p -138.34 101.53 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.596 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.719 HG21 HD22 ' A' ' 45' ' ' LEU . 36.2 t -92.69 129.23 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.161 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.81 107.41 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 120.909 0.385 . . . . 0.0 110.753 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 121.047 0.451 . . . . 0.0 111.411 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 23.0 t-20 -143.64 123.66 13.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.4 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -86.85 145.58 26.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.398 0.618 . . . . 0.0 111.361 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.939 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -115.37 141.37 48.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.97 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.939 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.32 156.1 39.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.158 0.504 . . . . 0.0 110.555 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.776 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.56 105.34 3.07 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.496 0.665 . . . . 0.0 111.715 -177.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.647 HG23 ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -122.31 -175.92 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.909 -179.674 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.647 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -59.73 -63.91 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.558 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -173.43 -18.64 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.7 m -42.41 -32.1 0.49 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.991 0.424 . . . . 0.0 111.011 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.649 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.59 -61.64 2.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.548 179.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.467 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 7.3 tp -52.6 -52.83 53.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.71 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.591 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -66.42 -34.88 78.95 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.682 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.09 -52.52 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.909 0.385 . . . . 0.0 110.438 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.719 HD22 HG21 ' A' ' 12' ' ' VAL . 0.5 OUTLIER -78.71 -54.54 6.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.748 179.516 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.532 ' N ' HG11 ' A' ' 53' ' ' VAL . 1.3 tptt -53.47 -24.05 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.304 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.26 -29.94 1.82 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 111.372 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -128.62 125.78 23.2 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 61.28 4.96 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.405 2.07 . . . . 0.0 112.366 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.805 ' C ' HD13 ' A' ' 51' ' ' LEU . 20.8 mmt-85 -123.91 -39.69 2.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.805 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.0 OUTLIER -119.85 133.44 55.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.962 0.41 . . . . 0.0 110.971 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 12' ' ' VAL . 4.2 t -68.87 107.21 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.768 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.532 HG11 ' N ' ' A' ' 46' ' ' LYS . 2.1 p -103.4 115.26 45.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.938 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.754 ' O ' HG22 ' A' ' 10' ' ' VAL . 31.0 mt-30 -127.07 144.9 50.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.833 -0.622 . . . . 0.0 112.165 -178.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.748 HG22 HG23 ' A' ' 10' ' ' VAL . 1.9 pt -102.64 134.39 43.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.176 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.8 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.962 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.561 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.0 mm? . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.866 0.365 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -48.97 -37.18 19.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.495 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 38.3 p -61.98 -15.21 42.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -94.23 133.8 37.37 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.804 0.335 . . . . 0.0 110.675 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.671 ' O ' HG13 ' A' ' 94' ' ' VAL . 3.0 p -74.45 -94.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.359 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.671 HG13 ' O ' ' A' ' 93' ' ' THR . 1.4 m -164.41 -38.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.054 0.454 . . . . 0.0 110.79 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.75 -20.88 38.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.691 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -66.95 -52.23 45.45 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.349 0.595 . . . . 0.0 109.74 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 1.044 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.92 -59.61 4.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.715 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.45 ' HE3' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -44.65 -38.35 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.939 178.431 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.19 -21.92 28.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.048 0.452 . . . . 0.0 111.669 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 6.8 mm-40 -86.37 -47.81 9.02 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.09 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.667 HD13 HG21 ' A' ' 106' ' ' ILE . 5.5 mt -51.89 -48.3 64.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.164 0.506 . . . . 0.0 109.845 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.497 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -62.12 -41.42 98.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.229 179.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.74 -6.96 50.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.106 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -105.81 -15.43 14.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 78.5 70.94 1.27 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.94 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.718 HG23 ' N ' ' A' ' 107' ' ' THR . 0.2 OUTLIER -128.26 -159.33 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.718 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -140.45 116.11 10.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.838 0.351 . . . . 0.0 110.791 179.88 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.497 ' CZ ' HG23 ' A' ' 102' ' ' THR . 2.4 p90 -138.72 105.85 5.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.987 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -176.78 37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.783 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.52 -50.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 91.6 p -101.05 -63.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.465 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -70.61 64.79 0.3 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.07 0.462 . . . . 0.0 110.334 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -61.19 -75.14 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.346 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.976 ' O ' HG23 ' A' ' 118' ' ' ILE . 1.5 ptmt -146.3 -57.46 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.718 0.294 . . . . 0.0 111.434 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.24 -23.01 64.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.863 0.363 . . . . 0.0 111.115 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.4 mm-40 -85.82 -36.29 20.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.855 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.765 ' HG ' HD13 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -74.48 -37.11 63.28 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.597 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 1.044 ' HA ' HD22 ' A' ' 97' ' ' LEU . 1.7 pp -64.72 -35.19 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.579 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.33 -28.26 23.79 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.891 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.789 HD22 ' O ' ' A' ' 120' ' ' LEU . 1.0 OUTLIER -65.01 -30.6 71.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.687 -179.086 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.507 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 120.721 0.296 . . . . 0.0 111.151 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.844 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.637 0.256 . . . . 0.0 110.793 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.488 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.22 144.09 30.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.43 0.633 . . . . 0.0 112.393 -179.522 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.4 p -95.1 121.83 37.14 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.801 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 151.53 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 111.355 -178.775 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.9 p -134.17 123.5 43.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.242 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.119 HG13 HD23 ' A' ' 45' ' ' LEU . 1.8 m -95.65 104.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.784 -179.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.43 106.89 19.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.896 178.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 . . . . . 0 C--N 1.329 -0.297 0 CA-C-O 121.24 0.543 . . . . 0.0 111.61 -179.2 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.484 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 2.2 p30 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.679 0.276 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.2 t30 -116.74 131.94 56.82 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.291 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.02 145.54 26.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.536 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.961 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -113.75 140.61 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.19 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.961 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.29 157.5 37.59 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.202 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.844 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.4 112.74 6.14 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.734 0.778 . . . . 0.0 111.2 -177.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.547 ' N ' HG22 ' A' ' 7' ' ' THR . 3.5 t -128.35 168.82 20.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 CA-C-N 114.463 -1.244 . . . . 0.0 110.584 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.54 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.2 m -55.3 -61.25 2.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.273 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -164.91 -16.76 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.488 ' OG ' HG11 ' A' ' 37' ' ' VAL . 3.0 p -43.62 -33.67 1.25 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.501 ' CD ' ' N ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -65.79 -37.43 86.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.799 0.333 . . . . 0.0 111.749 -179.61 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.501 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.2 tp -68.31 -38.75 81.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -86.86 -28.99 22.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.276 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -47.93 81.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.874 0.369 . . . . 0.0 110.378 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 1.119 HD23 HG13 ' A' ' 12' ' ' VAL . 1.9 mp -79.02 -41.53 28.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.46 ' N ' HG11 ' A' ' 53' ' ' VAL . 3.5 ttpt -73.27 -12.74 60.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.299 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.565 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -50.81 -33.29 22.92 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.822 0.344 . . . . 0.0 111.295 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 p-10 -121.66 129.83 25.03 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.83 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -77.09 70.82 6.52 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.5 2.134 . . . . 0.0 112.272 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.431 ' C ' HD12 ' A' ' 51' ' ' LEU . 2.0 mtt85 -131.8 -56.01 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.886 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.555 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.8 mp -100.51 170.46 8.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.628 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.9 t -105.58 107.39 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.608 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.509 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 1.5 p -101.18 114.57 40.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.29 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.476 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.8 OUTLIER -127.12 125.93 42.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.454 -179.232 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.801 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.19 145.79 7.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.289 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 44.3 p . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.644 179.694 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 118' ' ' ILE . 12.5 tp . . . . . 0 N--CA 1.462 0.143 0 CA-C-O 120.644 0.259 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.8 m-20 -48.78 -45.63 40.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.428 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.3 p -62.09 -14.55 37.63 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -84.09 143.82 29.46 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.684 0.278 . . . . 0.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 69.9 p -110.63 -88.23 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.588 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.617 HG13 ' HG3' ' A' ' 114' ' ' LYS . 40.6 t -154.56 -43.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -80.3 -20.84 43.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.081 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.1 -49.58 42.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 0.0 110.19 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.776 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -56.02 -58.56 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.528 179.557 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.476 ' HE2' HD11 ' A' ' 117' ' ' LEU . 4.1 ttmt -55.63 -34.67 65.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.02 -21.64 29.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.056 0.455 . . . . 0.0 111.573 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.466 ' N ' ' O ' ' A' ' 96' ' ' GLN . 3.5 mm-40 -86.53 -41.09 14.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.302 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.69 HD22 HG21 ' A' ' 106' ' ' ILE . 12.9 mt -56.14 -49.91 72.61 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.315 0.579 . . . . 0.0 109.754 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.69 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -64.11 -38.96 92.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.324 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.65 -6.84 53.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.957 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.3 mtt180 -100.36 -15.32 18.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.858 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.96 47.58 4.97 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.838 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.69 HG21 HD22 ' A' ' 101' ' ' LEU . 9.2 tt -140.43 95.91 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.822 0.344 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.03 122.94 9.33 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.951 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.69 ' HE1' HG23 ' A' ' 102' ' ' THR . 13.7 p90 -121.56 28.02 7.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.131 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -29.34 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.852 0.358 . . . . 0.0 110.77 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -124.98 150.97 46.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.855 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.15 26.34 13.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 108' ' ' PHE . . . -148.53 103.99 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.18 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.4 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 72.3 p -98.92 -79.38 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.725 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.668 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 20.4 tttt -158.4 -39.5 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.087 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.7 -20.44 33.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.028 0.442 . . . . 0.0 110.224 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -85.59 -39.08 17.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.756 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.668 ' CD2' ' HA ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -78.31 -19.55 53.31 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.153 -179.771 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.776 ' HA ' HD22 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -80.79 -28.39 11.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 120.566 -0.453 . . . . 0.0 109.974 178.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.428 ' HA ' HD11 ' A' ' 89' ' ' LEU . . . -87.09 -33.12 19.59 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.133 0.492 . . . . 0.0 111.106 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.18 -42.76 70.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.269 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.578 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 30.7 m-85 . . . . . 0 C--N 1.329 -0.314 0 CA-C-O 120.917 0.389 . . . . 0.0 111.305 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.867 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.686 0.279 . . . . 0.0 110.821 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.501 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.17 143.81 30.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.434 0.635 . . . . 0.0 112.632 -179.659 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 24.4 p -95.55 121.4 37.2 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.772 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.73 150.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.003 0.43 . . . . 0.0 111.282 -178.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.4 p -134.06 120.58 35.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.259 0.552 . . . . 0.0 111.522 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.723 HG11 HD22 ' A' ' 45' ' ' LEU . 11.5 m -94.17 104.53 15.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.382 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -98.63 105.28 17.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.419 . . . . 0.0 110.15 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.642 HD21 HG13 ' A' ' 52' ' ' VAL . 13.1 m120 . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.065 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.404 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.758 0.314 . . . . 0.0 110.735 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 17.9 t30 -129.94 131.04 45.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.943 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.14 145.48 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.302 0.572 . . . . 0.0 111.121 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.966 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.72 140.46 46.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.26 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.966 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.26 157.63 37.35 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.11 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.867 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.6 112.13 5.88 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.685 0.755 . . . . 0.0 111.287 -177.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.553 ' N ' HG22 ' A' ' 7' ' ' THR . 4.1 t -127.77 168.26 21.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.088 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.656 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.524 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.7 t -55.09 -58.85 5.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.397 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -167.91 -17.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.5 m -43.43 -33.25 1.03 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.551 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -66.52 -41.45 88.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.829 0.347 . . . . 0.0 111.837 -179.551 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.478 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 4.8 tp -66.77 -34.36 77.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.501 -178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -91.94 -30.71 15.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.632 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.31 -42.42 88.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.947 0.403 . . . . 0.0 110.41 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.723 HD22 HG11 ' A' ' 12' ' ' VAL . 63.0 mt -79.04 -47.22 16.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.925 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.414 ' N ' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -60.44 -17.82 47.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.438 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.13 -39.87 6.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.801 0.334 . . . . 0.0 111.65 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.1 121.56 58.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -84.17 49.42 2.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.677 2.252 . . . . 0.0 112.774 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.23 -38.1 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.272 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.739 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -93.55 -165.59 1.36 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.426 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.672 ' O ' HG12 ' A' ' 12' ' ' VAL . 2.3 m -132.56 133.0 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.414 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.6 p -131.83 112.83 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.021 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.514 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.4 OUTLIER -127.66 126.21 41.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.837 -178.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.772 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.4 pp -88.11 126.66 41.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.042 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.1 p . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 179.88 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 89' ' ' LEU . 3.1 mm? . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.586 0.231 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -49.07 -50.12 38.27 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.726 0.298 . . . . 0.0 111.132 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -13.05 25.9 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -94.84 122.82 37.86 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.643 0.259 . . . . 0.0 110.6 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.555 ' O ' HD11 ' A' ' 97' ' ' LEU . 15.9 p -117.98 -95.49 0.48 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.349 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.954 ' HA ' HD21 ' A' ' 97' ' ' LEU . 3.4 m -138.2 -34.87 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.89 0.376 . . . . 0.0 111.438 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -82.78 -20.41 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.283 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -38.22 21.98 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.954 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -76.3 -49.21 17.56 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.024 -0.671 . . . . 0.0 109.717 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.691 ' HE2' HD11 ' A' ' 117' ' ' LEU . 0.9 OUTLIER -56.44 -33.75 66.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.696 178.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.18 -25.76 27.21 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 111.973 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 3.5 mt-30 -86.68 -42.82 13.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.014 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.924 HD22 HG21 ' A' ' 106' ' ' ILE . 6.6 mt -54.48 -48.1 72.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.087 0.47 . . . . 0.0 110.385 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -39.64 92.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.062 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -6.85 52.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -106.17 -15.22 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.047 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.89 68.4 1.56 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.774 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.924 HG21 HD22 ' A' ' 101' ' ' LEU . 0.4 OUTLIER -119.28 -146.74 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.641 ' N ' HG23 ' A' ' 106' ' ' ILE . 4.8 t -150.78 105.11 3.24 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 122.169 -0.332 . . . . 0.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.656 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.8 p90 -142.92 66.28 1.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.948 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.35 -31.14 7.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.48 62.11 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.045 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 179.35 -38.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.024 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.656 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -112.49 108.31 17.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.017 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.75 -74.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.308 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.792 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -144.83 -43.89 0.24 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -78.78 -24.31 44.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.929 0.395 . . . . 0.0 110.569 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.6 mm-40 -85.94 -36.5 19.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.563 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.834 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -80.04 -19.71 46.97 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.204 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.834 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -27.01 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.99 -34.55 19.22 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.764 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.5 tp -51.57 -44.4 62.73 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.472 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.471 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 4.9 m-85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.749 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 5.6 t . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.82 0.343 . . . . 0.0 110.761 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.08 152.25 38.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.098 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 2.6 m -92.4 124.96 36.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -110.12 151.18 12.41 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 111.659 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -138.01 132.9 43.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.368 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.646 HG12 ' O ' ' A' ' 52' ' ' VAL . 28.0 m -101.97 104.71 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.795 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.438 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -101.34 106.59 17.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.006 179.01 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.253 0.549 . . . . 0.0 111.671 -179.265 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.438 ' HB3' ' CG ' ' A' ' 13' ' ' GLN . 3.5 p-10 . . . . . 0 N--CA 1.456 -0.129 0 CA-C-O 121.038 0.447 . . . . 0.0 111.265 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.427 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 16.2 m-20 -126.71 127.53 45.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.956 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.7 m -86.96 145.32 26.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.422 0.63 . . . . 0.0 111.739 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.957 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -111.51 138.22 48.32 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.698 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.957 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.48 156.41 39.41 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.923 0.392 . . . . 0.0 110.192 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.749 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.72 109.96 5.24 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.431 0.634 . . . . 0.0 111.723 -177.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.649 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -128.78 -177.01 1.74 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.039 -179.654 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.649 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -51.13 -64.85 0.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.366 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -177.75 -16.59 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.25 -34.47 0.78 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.586 ' HG2' HD11 ' A' ' 34' ' ' LEU . 1.4 pp0? -57.25 -49.87 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 0.0 111.232 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -56.14 -53.66 54.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.088 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.19 -27.0 64.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.216 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -64.5 -51.85 60.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.86 0.362 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.536 ' HG ' ' CG1' ' A' ' 12' ' ' VAL . 3.2 mm? -78.51 -32.18 47.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.088 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.653 ' HB2' HG11 ' A' ' 53' ' ' VAL . 13.8 tttt -75.11 -29.6 60.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.156 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -56.12 -62.84 1.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.6 120.43 81.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.83 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.41 59.91 6.85 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.514 2.142 . . . . 0.0 112.41 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.521 ' C ' HD13 ' A' ' 51' ' ' LEU . 1.9 mpt_? -115.91 -64.54 1.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.982 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.632 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -106.99 -176.82 3.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.566 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 12' ' ' VAL . 3.1 m -103.55 146.37 11.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.774 0.321 . . . . 0.0 111.782 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.653 HG11 ' HB2' ' A' ' 46' ' ' LYS . 4.8 p -126.66 116.72 45.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.805 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.743 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -127.41 139.54 52.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.336 -179.482 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.429 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -95.11 117.66 39.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.36 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.5 p . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.68 179.817 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.491 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.1 mm? . . . . . 0 C--O 1.23 0.027 0 CA-C-O 120.853 0.359 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -48.93 -43.65 39.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.633 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.0 m -61.99 -14.19 32.88 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.533 ' CD1' ' CE2' ' A' ' 121' ' ' PHE . 24.0 m-85 -114.13 104.8 12.48 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.819 0.343 . . . . 0.0 110.644 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.409 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.2 OUTLIER -84.48 -86.58 0.12 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.164 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.798 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 11.3 t -148.25 -56.61 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.775 0.321 . . . . 0.0 111.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.44 -20.18 61.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.963 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -20.88 42.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.124 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.69 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -78.4 -58.56 3.19 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.401 -179.619 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.798 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.3 ptpt -62.14 -25.68 67.88 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.274 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.76 -29.55 25.38 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.021 0.438 . . . . 0.0 112.164 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 29.0 mt-30 -86.72 -29.4 22.43 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.738 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.852 HD22 ' HB ' ' A' ' 106' ' ' ILE . 6.0 mt -67.05 -46.29 74.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.22 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.729 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.988 179.553 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.97 -6.81 49.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.087 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.3 mtt-85 -106.44 -15.3 14.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.957 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.93 64.45 1.42 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.841 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.852 ' HB ' HD22 ' A' ' 101' ' ' LEU . 18.1 mt -151.16 100.49 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.66 0.267 . . . . 0.0 111.167 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -57.18 122.25 12.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.84 0.352 . . . . 0.0 110.921 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.729 ' HE1' HG23 ' A' ' 102' ' ' THR . 13.8 p90 -130.56 5.54 4.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.547 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -99.14 31.48 3.03 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 0.0 110.91 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.38 25.97 0.6 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.5 p 177.19 -37.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.914 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.466 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -82.99 175.89 9.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.3 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.552 ' O ' HD13 ' A' ' 117' ' ' LEU . 25.0 p -150.55 -80.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.748 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.5 pttt -145.35 -46.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.458 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.59 -25.2 41.6 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 0.0 110.264 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.14 -36.73 19.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.401 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.925 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -79.7 -19.42 48.96 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.054 -179.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.925 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.74 -30.18 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 120.874 0.369 . . . . 0.0 110.268 178.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.83 -32.38 19.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.286 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.837 HD11 HD21 ' A' ' 101' ' ' LEU . 1.5 pp -72.5 -17.11 61.77 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.633 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.75 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 9.5 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.843 0.354 . . . . 0.0 110.647 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.07 146.03 29.85 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.4 m -94.63 115.86 28.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.879 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -110.27 151.74 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.131 0.491 . . . . 0.0 112.061 -178.312 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.562 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.3 p -138.08 128.2 35.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.151 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.062 HG13 HD13 ' A' ' 45' ' ' LEU . 23.4 m -96.78 104.81 16.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.921 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.94 106.53 18.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.024 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.916 ' CB ' HD22 ' A' ' 51' ' ' LEU . 21.8 p-10 . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 121.089 0.471 . . . . 0.0 112.185 -179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.422 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 121.005 0.431 . . . . 0.0 111.114 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.0 t30 -107.1 122.0 45.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.871 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.1 p -86.7 145.45 26.68 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.538 0.685 . . . . 0.0 111.544 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.934 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -117.2 139.12 51.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.25 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.934 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.85 156.93 38.96 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 120.825 0.345 . . . . 0.0 110.102 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.75 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.23 107.07 3.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.474 0.654 . . . . 0.0 111.544 -177.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.695 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -124.66 -175.91 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.296 -179.401 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.695 ' N ' HG23 ' A' ' 37' ' ' VAL . 16.4 m -51.68 -68.02 0.2 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.528 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -176.1 -21.43 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.4 -35.23 0.97 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.882 0.372 . . . . 0.0 111.478 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.733 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.22 -39.03 69.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.52 179.81 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.496 HD13 ' CG2' ' A' ' 55' ' ' ILE . 6.1 tp -70.58 -39.67 73.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.775 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.47 -27.37 56.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.53 -45.02 66.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.009 0.433 . . . . 0.0 110.491 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 1.062 HD13 HG13 ' A' ' 12' ' ' VAL . 51.4 mt -78.7 -30.6 46.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.014 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -69.84 -19.65 63.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.224 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.14 -55.01 27.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.38 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.41 118.65 64.38 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.999 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -81.85 54.7 5.17 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.632 2.221 . . . . 0.0 112.394 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -149.14 -63.28 0.23 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.719 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.916 HD22 ' CB ' ' A' ' 14' ' ' ASN . 18.1 mt -63.66 175.93 0.99 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.489 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.504 ' O ' HG23 ' A' ' 52' ' ' VAL . 3.4 m -120.55 123.06 69.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.493 HG22 HD12 ' A' ' 42' ' ' LEU . 2.0 p -116.9 106.28 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 0.0 110.299 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.517 ' O ' HG22 ' A' ' 10' ' ' VAL . 5.0 mt-30 -127.48 131.21 50.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.021 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.879 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.07 119.24 35.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.264 0.554 . . . . 0.0 111.622 -179.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 p . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.466 179.779 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.464 0.272 0 CA-C-O 120.695 0.283 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -48.86 -47.34 42.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.475 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.9 p -62.14 -12.78 21.52 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -115.46 122.43 45.73 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.674 0.273 . . . . 0.0 110.435 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.438 ' N ' HD11 ' A' ' 97' ' ' LEU . 93.5 m -84.75 -98.69 0.06 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.48 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.778 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 43.3 t -142.31 -56.84 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.075 0 CA-C-O 120.816 0.341 . . . . 0.0 111.361 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.25 -20.13 61.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.819 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.52 -21.18 38.76 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.083 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.768 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -75.35 -58.74 3.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.357 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.86 ' O ' HG23 ' A' ' 102' ' ' THR . 1.8 ptpt -57.82 -26.9 62.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.95 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.09 29.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.044 0.45 . . . . 0.0 111.663 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -86.79 -38.28 17.02 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 101' ' ' LEU . 22.8 mt -63.83 -42.64 97.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.662 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.86 HG23 ' O ' ' A' ' 98' ' ' LYS . 12.7 p -65.73 -40.82 92.56 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.113 0.482 . . . . 0.0 109.907 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -6.91 50.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.348 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 36.6 mtt180 -106.03 -15.27 14.94 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.158 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.35 42.25 5.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.598 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 23.4 mm -128.41 92.27 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.714 0.293 . . . . 0.0 111.201 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 p -57.75 151.13 18.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.847 0.356 . . . . 0.0 110.864 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.66 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.3 p90 -153.5 36.66 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.017 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -45.41 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -134.72 24.47 3.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.005 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 -33.58 4.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.993 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.66 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -139.67 119.64 13.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.142 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.499 ' O ' HD13 ' A' ' 117' ' ' LEU . 68.6 p -92.21 -73.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.693 ' O ' HG22 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -145.25 -40.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -24.05 32.77 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.5 mm-40 -86.08 -38.46 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.434 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.922 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -76.25 -19.91 57.9 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.587 -0.278 . . . . 0.0 111.213 -179.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.922 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.6 -33.17 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.249 -0.58 . . . . 0.0 109.582 177.927 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.43 -28.28 22.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 18.5 tp -48.77 -43.79 38.17 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.252 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.55 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 9.2 m-85 . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.535 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.92 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.514 0.197 . . . . 0.0 110.695 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.81 145.68 31.76 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.8 p -94.12 133.15 37.92 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.738 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -109.98 148.3 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.522 0.677 . . . . 0.0 111.85 -178.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.9 p -138.15 101.18 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.958 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.068 HG21 HD22 ' A' ' 45' ' ' LEU . 78.9 t -92.6 136.71 24.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.196 -178.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -119.3 112.45 19.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.572 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.05 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.858 0.361 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.4 p-10 -124.75 133.12 53.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.21 145.61 26.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.069 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.943 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -113.33 143.07 45.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.191 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.943 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.62 156.72 39.09 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-O 121.091 0.472 . . . . 0.0 110.402 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.92 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.24 115.64 9.67 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.415 0.626 . . . . 0.0 111.551 -177.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.626 HG23 ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -129.72 -173.24 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.958 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.626 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -65.35 -59.19 4.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.552 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -171.2 -16.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.1 m -42.23 -40.82 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.745 HE22 HG22 ' A' ' 55' ' ' ILE . 0.0 OUTLIER -57.37 -43.04 83.2 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.216 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.557 HD13 HG23 ' A' ' 55' ' ' ILE . 19.7 tp -64.52 -55.36 21.11 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.194 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.736 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.99 -23.14 62.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.537 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.25 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.861 0.362 . . . . 0.0 110.276 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 1.068 HD22 HG21 ' A' ' 12' ' ' VAL . 0.8 OUTLIER -78.93 -57.47 3.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.931 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.487 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -51.85 -23.27 4.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.609 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.736 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -43.37 -31.43 0.67 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.781 0.324 . . . . 0.0 111.498 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.04 128.01 24.59 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.683 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.95 77.42 2.73 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.426 2.084 . . . . 0.0 112.22 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.61 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -146.54 -45.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.184 -179.846 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.61 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -110.61 124.8 52.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.974 0.416 . . . . 0.0 110.827 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.413 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.0 t -64.7 106.06 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.625 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.828 ' HA ' HG22 ' A' ' 12' ' ' VAL . 2.9 p -99.03 123.97 51.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.147 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.738 ' O ' HG22 ' A' ' 10' ' ' VAL . 19.8 pt20 -127.0 141.09 51.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.081 -178.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.745 HG22 HE22 ' A' ' 41' ' ' GLN . 1.0 OUTLIER -100.58 112.7 34.15 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.039 179.539 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 56' ' ' THR . 3.3 t . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.424 HD13 ' HA ' ' A' ' 89' ' ' LEU . 2.3 mm? . . . . . 0 N--CA 1.466 0.348 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -48.44 -45.02 35.91 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.565 0.221 . . . . 0.0 111.288 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 p -62.11 -13.21 24.48 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.404 ' HB3' HD12 ' A' ' 97' ' ' LEU . 5.7 m-85 -90.07 115.61 27.47 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.681 0.277 . . . . 0.0 110.427 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.785 HG22 HG22 ' A' ' 94' ' ' VAL . 90.4 m -91.22 -107.46 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.778 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.822 ' HA ' HD21 ' A' ' 97' ' ' LEU . 10.0 m -135.61 -32.02 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.25 0 CA-C-O 120.916 0.389 . . . . 0.0 111.494 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -83.58 -20.0 34.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.736 0.303 . . . . 0.0 111.068 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.6 OUTLIER -81.53 -32.61 32.21 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.571 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.832 HD13 ' H ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -77.87 -50.03 13.07 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -179.788 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.568 ' H ' HD22 ' A' ' 97' ' ' LEU . 3.3 ptpt -62.24 -28.11 69.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.86 -30.39 24.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.963 0.411 . . . . 0.0 111.98 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -86.82 -27.9 23.24 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.675 HD22 HG21 ' A' ' 106' ' ' ILE . 6.5 mt -64.73 -47.23 79.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.261 0.553 . . . . 0.0 109.742 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -34.83 74.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.749 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.28 -12.57 61.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.314 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.57 ' HD3' HD23 ' A' ' 101' ' ' LEU . 9.6 ptm180 -110.89 -15.26 13.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.052 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.05 82.72 0.79 Allowed Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.791 -0.718 . . . . 0.0 113.16 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.675 HG21 HD22 ' A' ' 101' ' ' LEU . 8.4 tp -126.74 -40.83 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.698 0.285 . . . . 0.0 111.376 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.431 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.2 OUTLIER 73.65 90.83 0.09 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.846 0.355 . . . . 0.0 110.624 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.91 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 14.1 p90 -115.26 139.03 50.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.114 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -43.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.788 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -128.22 27.41 5.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.67 30.27 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.97 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.91 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -178.46 59.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.015 0.436 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.607 ' O ' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -59.79 -83.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.7 ' HA ' HD22 ' A' ' 117' ' ' LEU . 4.3 ptpt -139.62 -43.79 0.44 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.812 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.86 -24.5 41.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.998 0.428 . . . . 0.0 110.253 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -86.19 -36.55 19.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.837 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.93 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.97 -21.57 50.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.375 -179.145 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.93 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.12 -27.54 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.148 177.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.21 -34.17 19.09 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.143 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -49.33 -46.26 46.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.871 -179.003 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.613 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 53.0 m-85 . . . . . 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.399 . . . . 0.0 111.348 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.787 HG22 ' C ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.756 0.312 . . . . 0.0 110.598 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.472 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.15 146.46 31.79 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.523 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.3 p -96.9 119.81 36.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.755 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.76 151.55 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.176 0.513 . . . . 0.0 111.633 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.564 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -134.94 126.27 46.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.086 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.065 HG13 HD13 ' A' ' 45' ' ' LEU . 9.0 m -95.86 104.77 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.341 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -88.82 106.56 18.46 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-O 121.447 0.641 . . . . 0.0 111.946 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.559 ' HB2' HG22 ' A' ' 11' ' ' VAL . 36.4 p-10 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.908 0.385 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.8 t-20 -122.01 136.46 54.92 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.083 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.02 145.2 26.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.492 0.663 . . . . 0.0 111.715 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.938 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -111.97 141.44 45.63 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.885 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.938 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.39 157.58 37.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.393 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.787 ' C ' HG22 ' A' ' 7' ' ' THR . . . -69.5 112.02 5.73 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.622 0.725 . . . . 0.0 111.243 -177.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.543 ' N ' HG22 ' A' ' 7' ' ' THR . 5.3 t -127.84 168.62 20.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.64 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.525 ' H ' HG12 ' A' ' 37' ' ' VAL . 19.4 t -54.36 -62.07 1.9 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.525 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -164.92 -16.61 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.42 -45.27 4.31 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.498 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -53.4 -47.04 69.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.801 0.334 . . . . 0.0 111.693 -179.619 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.437 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 8.7 tp -57.89 -46.56 84.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.518 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.18 -28.44 48.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.661 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -50.69 67.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.938 0.399 . . . . 0.0 110.712 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 1.065 HD13 HG13 ' A' ' 12' ' ' VAL . 32.4 mt -79.0 -34.3 44.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.414 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.57 ' N ' HG11 ' A' ' 53' ' ' VAL . 1.7 ttmt -77.7 -10.27 59.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.322 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.47 -45.54 73.19 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.717 0.294 . . . . 0.0 111.261 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -93.28 127.95 44.7 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -79.31 85.79 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.518 2.145 . . . . 0.0 112.565 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -167.13 -72.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.855 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.47 171.03 3.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.609 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.5 t -115.35 106.75 21.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.927 0.394 . . . . 0.0 111.908 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.57 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.3 p -104.02 111.19 32.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.05 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.508 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.3 mm-40 -127.17 133.54 50.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.523 -179.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.755 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.31 133.37 30.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.119 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.3 p . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.792 -179.927 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.463 ' HA ' HD12 ' A' ' 89' ' ' LEU . 8.7 tp . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.594 0.235 . . . . 0.0 111.294 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -49.17 -50.25 38.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.655 0.265 . . . . 0.0 111.125 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.22 -10.18 14.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.439 ' CD1' ' HA ' ' A' ' 89' ' ' LEU . 4.4 m-85 -88.29 120.92 30.11 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.6 0.238 . . . . 0.0 110.528 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.6 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -133.8 -91.48 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.876 ' HA ' HD21 ' A' ' 97' ' ' LEU . 20.4 t -131.39 -44.58 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 121.027 0.441 . . . . 0.0 111.65 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.428 ' O ' ' HB3' ' A' ' 99' ' ' ALA . 5.7 pt-20 -82.29 -19.99 38.39 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -85.72 -29.29 24.04 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.876 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -84.59 -55.24 4.23 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.453 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.802 ' HE2' HD11 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -55.13 -32.83 62.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.794 178.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 95' ' ' GLU . . . -85.36 -24.85 27.42 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.989 0.423 . . . . 0.0 112.086 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 71.5 mt-30 -86.57 -45.29 11.2 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.923 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.531 HD22 ' HB ' ' A' ' 106' ' ' ILE . 4.7 mt -50.89 -49.05 60.16 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.994 0.426 . . . . 0.0 110.38 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.589 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -66.66 -38.27 86.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.113 179.599 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -77.17 -6.69 53.92 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.333 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -104.07 -15.18 15.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.215 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.57 ' O ' HD13 ' A' ' 106' ' ' ILE . . . 88.98 47.02 4.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.549 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.57 HD13 ' O ' ' A' ' 105' ' ' GLY . 21.7 mm -133.38 91.21 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 0.0 111.078 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 27.3 p -54.64 119.82 5.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.953 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.589 ' HE1' HG23 ' A' ' 102' ' ' THR . 14.6 p90 -117.5 74.24 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.873 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.29 39.81 2.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.759 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -121.49 -47.03 2.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.013 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.16 33.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.039 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -116.66 90.1 3.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.987 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.84 -76.67 0.15 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.04 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.541 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -147.21 -39.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.417 ' HA ' HG22 ' A' ' 118' ' ' ILE . . . -77.57 -22.12 51.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 110.658 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 12.7 mm-40 -85.58 -37.96 18.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.85 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.864 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -82.37 -19.89 38.28 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.302 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.864 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.64 -25.24 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.589 177.749 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.72 -35.38 19.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.392 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -33.51 74.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.456 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.258 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.913 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.524 0.202 . . . . 0.0 110.467 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.46 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.9 135.29 24.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.675 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -89.74 119.98 30.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.835 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.88 156.0 10.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.905 0.383 . . . . 0.0 111.759 -177.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.22 117.48 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.069 0.461 . . . . 0.0 110.718 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.618 ' O ' HG23 ' A' ' 12' ' ' VAL . 27.1 m -93.14 110.37 23.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.166 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -91.86 111.54 23.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.301 0.572 . . . . 0.0 111.595 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 22.8 p-10 . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.841 0.353 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.431 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 0.9 OUTLIER -125.0 135.48 52.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.411 179.795 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.5 m -87.11 145.5 26.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.343 0.592 . . . . 0.0 111.069 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.918 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -114.26 140.2 48.78 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.981 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.918 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.17 157.55 37.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.005 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.913 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.38 106.43 2.93 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.769 0.795 . . . . 0.0 111.168 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 35' ' ' ALA . 5.0 t -124.53 167.61 18.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 114.36 -1.291 . . . . 0.0 110.705 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.506 ' N ' HG12 ' A' ' 37' ' ' VAL . 0.7 OUTLIER -55.51 -64.95 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.433 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -160.25 -16.37 0.05 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.6 m -42.19 -38.14 1.65 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.73 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -63.22 -53.38 54.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.911 0.386 . . . . 0.0 111.309 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.423 ' N ' ' NE2' ' A' ' 41' ' ' GLN . 5.0 tp -57.78 -28.31 63.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.511 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -90.41 -40.47 12.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.683 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.6 tm0? -62.21 -40.73 97.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.808 0.337 . . . . 0.0 110.756 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.772 HD12 ' CG2' ' A' ' 53' ' ' VAL . 7.3 mt -78.84 -39.83 34.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.257 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -65.98 -12.89 58.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.537 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.46 -28.84 2.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.681 0.277 . . . . 0.0 111.504 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -129.48 110.02 17.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.13 -22.66 11.32 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.655 2.237 . . . . 0.0 112.654 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -45.79 -63.7 0.91 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.879 0.371 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.02 170.4 16.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.8 t -119.44 108.28 23.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.884 0.373 . . . . 0.0 111.679 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.772 ' CG2' HD12 ' A' ' 45' ' ' LEU . 1.5 p -105.89 111.32 34.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.494 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.546 ' O ' HG22 ' A' ' 10' ' ' VAL . 16.0 mt-30 -127.52 130.9 49.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.583 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.835 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.13 145.35 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.064 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.1 p . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.684 179.723 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.0 tp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.696 0.284 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -49.05 -47.2 45.01 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.437 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.5 p -62.33 -9.31 7.74 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.407 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 4.7 m-85 -100.16 137.27 38.83 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.602 0.239 . . . . 0.0 110.504 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.462 ' C ' HD11 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -123.17 -96.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.708 -0.223 . . . . 0.0 111.555 -179.591 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.924 ' HA ' HD21 ' A' ' 97' ' ' LEU . 4.2 m -142.97 -34.03 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -83.27 -20.47 34.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.257 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.414 ' O ' ' CB ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -83.34 -38.19 22.39 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.924 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -73.3 -46.28 50.51 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.355 -179.392 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.595 ' H ' HD22 ' A' ' 97' ' ' LEU . 3.1 ttmt -60.86 -37.29 81.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.885 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.28 -24.22 27.82 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 61.6 tt0 -86.82 -43.7 12.29 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.202 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 1.057 HD22 HG21 ' A' ' 106' ' ' ILE . 2.8 mt -55.7 -47.48 76.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.151 0.501 . . . . 0.0 110.121 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -42.06 98.25 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.246 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -8.15 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.041 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.72 -15.32 18.54 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.9 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.75 51.36 2.88 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.972 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 1.057 HG21 HD22 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -133.43 88.6 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.925 0.393 . . . . 0.0 111.022 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 156.27 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.091 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.814 ' HB3' ' HB3' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -142.76 -105.74 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.829 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.11 33.05 1.01 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.735 0.302 . . . . 0.0 111.556 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.86 -35.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.238 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 11.2 t -111.82 -32.17 6.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.08 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.814 ' HB3' ' HB3' ' A' ' 108' ' ' PHE . . . -114.09 119.81 38.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.903 0.382 . . . . 0.0 111.262 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -112.9 -55.58 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.531 ' HD3' HG12 ' A' ' 94' ' ' VAL . 0.0 OUTLIER -166.25 -39.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.629 179.549 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.11 -22.27 33.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.939 0.399 . . . . 0.0 110.632 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.677 ' O ' HD13 ' A' ' 120' ' ' LEU . 2.1 mt-10 -85.96 -38.11 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.954 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -80.65 -21.18 41.64 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.342 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.954 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -84.52 -28.36 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.933 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.03 -34.1 19.32 Favored 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.385 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.677 HD13 ' O ' ' A' ' 116' ' ' GLU . 2.0 mp -55.4 -34.1 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.402 -179.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.543 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 8.8 m-85 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.73 -179.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.76 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 13.6 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.048 0.451 . . . . 0.0 110.732 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.58 146.79 29.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.323 -179.575 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -89.04 124.65 34.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.676 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -110.37 153.6 12.1 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-O 121.322 0.582 . . . . 0.0 112.255 -178.06 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.2 p -138.68 123.73 22.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.197 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.892 ' CG1' HD13 ' A' ' 45' ' ' LEU . 35.6 m -93.37 108.87 21.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.966 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.408 ' O ' HG22 ' A' ' 52' ' ' VAL . 9.8 mt-30 -90.0 106.52 18.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.104 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.457 ' HB2' HG22 ' A' ' 11' ' ' VAL . 2.7 p30 . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 m-80 -122.41 145.75 47.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.052 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.31 145.31 26.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.469 0.652 . . . . 0.0 111.906 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.925 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -114.28 139.41 49.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.641 179.526 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.925 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -71.28 155.26 40.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.089 0.471 . . . . 0.0 110.612 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.76 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.23 114.37 9.23 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.327 0.584 . . . . 0.0 112.013 -178.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.689 HG22 ' HG3' ' A' ' 41' ' ' GLN . 0.8 OUTLIER -126.09 -171.66 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.232 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.676 ' N ' HG23 ' A' ' 37' ' ' VAL . 2.0 m -89.97 57.59 3.87 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' A' ' 41' ' ' GLN . 2.9 tt0 78.51 -16.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.413 ' HB3' HG21 ' A' ' 37' ' ' VAL . 0.3 OUTLIER -52.91 -21.51 4.39 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.344 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.689 ' HG3' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -79.96 -28.3 39.61 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.088 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HA ' HG21 ' A' ' 53' ' ' VAL . 3.5 tp -83.51 -31.78 26.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.018 0.437 . . . . 0.0 110.901 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.66 -29.07 22.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.02 -40.35 82.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.121 0.486 . . . . 0.0 109.986 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.983 HD12 HG23 ' A' ' 53' ' ' VAL . 49.0 mt -78.82 -39.58 35.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.782 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -28.04 67.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.031 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.32 -29.88 25.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.337 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.82 118.15 47.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.784 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -85.35 42.67 1.11 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.764 2.309 . . . . 0.0 112.765 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mtp85 -119.79 -38.78 2.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.741 0.305 . . . . 0.0 110.625 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.641 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -101.46 -179.11 3.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.179 179.233 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 13' ' ' GLN . 4.7 m -117.99 137.4 52.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.695 0.283 . . . . 0.0 111.626 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.983 HG23 HD12 ' A' ' 45' ' ' LEU . 4.0 p -125.96 113.1 32.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.094 0.474 . . . . 0.0 110.962 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.676 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.8 mt-30 -127.66 135.57 50.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.325 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.533 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.5 pp -88.56 113.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.491 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.674 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 tp . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.797 0.332 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -48.95 -42.77 38.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.464 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 35.3 m -61.89 -15.7 44.8 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -94.16 91.12 6.63 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 120.889 0.376 . . . . 0.0 110.227 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.3 p -65.09 -105.41 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.748 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.797 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 16.1 t -132.56 -56.48 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.876 0.369 . . . . 0.0 111.601 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.42 -19.78 66.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.113 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.17 -21.44 36.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.214 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -74.39 -58.68 3.14 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.797 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.3 ptpt -59.75 -29.83 68.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.667 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.53 -25.71 28.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.077 0.465 . . . . 0.0 111.75 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -86.73 -36.25 18.75 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.668 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.499 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 7.8 mt -58.54 -48.13 81.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.221 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.455 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -67.45 -38.49 84.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.965 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.97 -6.7 55.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.185 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.426 ' HG2' HD11 ' A' ' 106' ' ' ILE . 3.4 ttm-85 -102.79 -15.27 16.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.266 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.4 36.99 4.17 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.634 -0.794 . . . . 0.0 112.863 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.435 ' HB ' HD22 ' A' ' 101' ' ' LEU . 3.9 mp -141.56 91.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.72 0.295 . . . . 0.0 111.201 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.8 t -59.96 159.59 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.971 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.455 ' HE1' HG23 ' A' ' 102' ' ' THR . 1.8 p90 -150.14 72.82 1.13 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.691 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -66.02 -67.98 0.4 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.083 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -140.6 32.93 1.83 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -111.67 -34.3 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.877 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.632 ' HB1' ' HB3' ' A' ' 117' ' ' LEU . . . -119.84 85.5 2.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.891 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.475 ' O ' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.28 -85.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.114 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.731 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -140.44 -37.18 0.46 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.477 ' N ' ' HG2' ' A' ' 114' ' ' LYS . . . -83.18 -23.81 32.74 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.9 mt-10 -85.82 -36.88 19.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.357 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.922 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -80.09 -19.64 46.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.93 -179.655 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.922 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.59 -28.13 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.06 -33.56 19.48 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.998 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.6 tp -49.24 -41.03 36.2 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.085 -179.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.499 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 20.9 m-85 . . . . . 0 C--N 1.327 -0.411 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.217 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.887 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.654 0.264 . . . . 0.0 110.952 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.487 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.05 143.26 30.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.404 0.621 . . . . 0.0 112.493 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.5 p -95.54 121.67 37.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.71 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.8 150.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.025 0.441 . . . . 0.0 111.228 -179.005 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.2 p -135.82 124.54 38.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.298 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.567 HG13 ' HG ' ' A' ' 45' ' ' LEU . 11.3 m -93.14 104.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.369 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.36 108.02 19.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.628 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.651 ' ND2' HD12 ' A' ' 51' ' ' LEU . 8.4 t30 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.189 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 p30 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.828 0.347 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.457 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 8.9 m120 -116.34 124.46 50.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.617 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.16 145.62 26.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.464 0.649 . . . . 0.0 111.464 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.966 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -113.41 139.9 48.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.331 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.966 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.29 157.58 37.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.161 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.887 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.46 111.44 5.32 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.761 0.791 . . . . 0.0 111.214 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.542 ' N ' HG22 ' A' ' 7' ' ' THR . 4.5 t -127.6 168.3 20.98 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.461 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.513 ' H ' HG12 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -52.75 -69.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.742 0.306 . . . . 0.0 111.367 179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -156.71 -16.6 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 87.6 p -42.47 -44.52 4.09 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.546 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.72 -47.03 77.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.807 0.337 . . . . 0.0 111.721 -179.606 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.456 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 6.7 tp -49.24 -55.41 12.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.469 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.87 -27.9 61.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.18 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -51.77 68.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.662 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.567 ' HG ' HG13 ' A' ' 12' ' ' VAL . 2.9 mm? -78.82 -44.19 23.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.875 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -63.05 -17.71 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.245 179.885 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.77 -67.72 0.25 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.85 0.357 . . . . 0.0 111.56 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.91 133.58 41.04 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -84.98 48.64 2.38 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.689 2.259 . . . . 0.0 112.566 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.67 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER -111.42 -38.43 4.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.85 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.708 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -112.96 -176.51 2.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.728 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 m -116.34 128.57 73.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.213 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.471 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 3.3 p -116.09 116.27 51.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.09 120.65 29.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.239 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.71 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -88.36 139.26 17.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.24 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.611 179.762 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.645 HD12 ' O ' ' A' ' 118' ' ' ILE . 2.5 mm? . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.752 0.31 . . . . 0.0 111.105 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -49.02 -45.81 43.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.512 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -13.91 31.2 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -106.17 144.8 32.36 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 110.71 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.413 ' O ' HD21 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -98.98 -104.67 0.21 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.974 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.555 ' HA ' HD11 ' A' ' 97' ' ' LEU . 2.9 m -144.86 -38.71 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.763 0.316 . . . . 0.0 111.17 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -82.11 -21.2 36.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.461 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.2 OUTLIER -70.28 -52.35 23.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.289 0.566 . . . . 0.0 109.754 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.693 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.81 -57.91 7.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.53 179.185 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.723 ' HE2' HD11 ' A' ' 117' ' ' LEU . 1.8 ttmt -54.3 -36.78 64.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.544 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.89 -22.19 29.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.944 0.402 . . . . 0.0 112.001 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.457 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -87.0 -39.1 15.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.275 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.572 HD23 ' CZ ' ' A' ' 121' ' ' PHE . 1.4 mt -59.68 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.165 0.507 . . . . 0.0 110.034 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.554 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -64.33 -40.03 95.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.35 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.49 -6.56 53.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.289 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -100.18 -15.24 18.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.158 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.3 28.86 9.36 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.481 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.0 mt -121.95 88.43 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.762 0.315 . . . . 0.0 111.038 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 72.8 p -58.46 140.38 54.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.554 ' HE1' HG23 ' A' ' 102' ' ' THR . 15.5 p90 -138.78 74.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.24 -71.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -122.27 28.04 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.07 -31.79 6.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.922 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.546 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -134.51 107.31 7.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -79.89 -80.15 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.072 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.641 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -141.74 -37.91 0.4 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.797 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.59 -21.16 38.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.877 0.37 . . . . 0.0 110.563 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 46.7 mm-40 -85.74 -38.85 17.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.705 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.735 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -79.89 -19.34 48.41 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.486 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.807 HD13 ' O ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -83.25 -27.73 7.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.823 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.78 -33.13 18.76 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.988 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.525 HD23 HD11 ' A' ' 101' ' ' LEU . 18.1 tp -49.05 -44.15 41.49 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.306 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CZ ' HD23 ' A' ' 101' ' ' LEU . 96.2 m-85 . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.296 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.793 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.262 0 CA-C-O 121.009 0.433 . . . . 0.0 110.884 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.535 ' CE2' HD13 ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.4 121.81 10.32 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.417 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.2 p -111.35 127.73 55.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 177.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 1.002 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.84 153.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.08 0.467 . . . . 0.0 111.613 -178.553 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.7 p -138.03 106.54 3.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.849 HG21 HD22 ' A' ' 45' ' ' LEU . 82.2 t -92.48 134.12 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.937 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.401 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 1.1 mt-30 -119.71 108.47 14.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.134 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.393 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.404 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.1 t-20 -122.87 128.02 49.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.589 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 61.4 m -87.26 145.44 26.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.131 0.491 . . . . 0.0 111.506 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.847 HD13 ' O ' ' A' ' 35' ' ' ALA . 2.7 tm? -102.9 153.73 19.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.674 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.847 ' O ' HD13 ' A' ' 34' ' ' LEU . . . -71.18 157.85 37.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 121.601 0.715 . . . . 0.0 112.805 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.793 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.69 104.85 2.97 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.551 0.691 . . . . 0.0 110.843 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.643 HG12 ' H ' ' A' ' 38' ' ' SER . 1.1 t -115.43 -159.45 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.947 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.643 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.9 m -107.74 40.82 1.64 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.725 0.297 . . . . 0.0 111.069 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.45 ' CB ' ' O ' ' A' ' 38' ' ' SER . 3.3 tt0 85.75 -18.58 0.35 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.226 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.0 m -50.44 -34.02 23.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.121 0.486 . . . . 0.0 110.323 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.49 ' NE2' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.32 -44.81 76.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.383 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.455 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -57.24 -55.48 34.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.871 -179.415 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.53 -27.13 63.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -56.87 -51.04 70.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.849 HD22 HG21 ' A' ' 12' ' ' VAL . 0.5 OUTLIER -78.71 -52.96 7.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.665 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.537 ' CA ' HG11 ' A' ' 53' ' ' VAL . 0.3 OUTLIER -53.88 -24.25 15.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.232 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.54 -29.71 1.91 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.437 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -117.85 117.79 35.31 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.763 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.05 68.44 5.8 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.455 2.104 . . . . 0.0 112.27 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mmt-85 -128.26 -43.82 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.101 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 56.6 mt -124.72 142.58 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.982 0.42 . . . . 0.0 111.143 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.29 111.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.348 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.537 HG11 ' CA ' ' A' ' 46' ' ' LYS . 1.4 p -98.56 118.19 44.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.127 0.489 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.77 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -121.9 144.79 48.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.397 -179.219 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 1.002 HG22 HG23 ' A' ' 10' ' ' VAL . 1.8 pp -107.41 144.76 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.231 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 m . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.602 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 92' ' ' PHE . 47.6 tp . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.604 0.24 . . . . 0.0 111.52 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -49.04 -50.23 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.663 0.268 . . . . 0.0 111.408 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -1.3 9.82 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.505 ' HB2' HD12 ' A' ' 89' ' ' LEU . 2.4 m-85 -95.06 104.68 16.56 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.815 ' O ' HD21 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -123.79 -92.41 0.53 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.965 HG12 ' HZ1' ' A' ' 98' ' ' LYS . 2.0 t -125.5 -50.79 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-O 120.884 0.373 . . . . 0.0 111.773 -179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.34 -19.39 39.41 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.07 -25.97 29.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.828 ' N ' HD13 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -81.77 -53.26 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.509 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.965 ' HZ1' HG12 ' A' ' 94' ' ' VAL . 4.7 ptpt -57.92 -29.74 65.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.116 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.71 -25.47 28.34 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 16.2 mt-30 -86.87 -32.83 20.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.459 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 9.4 mt -61.14 -48.87 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -38.08 86.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.968 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -75.46 -6.89 52.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.957 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -113.72 13.74 18.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.007 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 58.48 60.79 8.28 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.748 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.2 mt -144.78 96.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.679 0.276 . . . . 0.0 111.18 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.3 p -52.72 149.63 5.97 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.786 0.327 . . . . 0.0 111.105 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -72.66 -50.93 21.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.808 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.14 160.45 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.988 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.15 76.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -178.36 -39.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.656 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -82.59 59.31 4.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.007 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.5 -71.9 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.227 -179.806 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.67 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -153.62 -41.25 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.579 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.85 -22.62 36.88 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.043 0.449 . . . . 0.0 110.199 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 81.6 mm-40 -85.94 -38.07 18.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.62 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.982 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.05 -24.07 51.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.335 -179.12 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.982 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.29 -26.57 7.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.182 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.98 -35.16 19.0 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.239 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 14.3 tp -50.33 -46.65 55.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.894 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.505 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 20.5 m-85 . . . . . 0 C--N 1.33 -0.281 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.895 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.46 0.075 0 CA-C-O 120.673 0.273 . . . . 0.0 110.392 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.484 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.01 145.91 31.7 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.276 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.9 p -96.18 126.43 41.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.685 HG11 HD12 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -109.89 150.68 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.109 0.481 . . . . 0.0 111.369 -178.872 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.4 p -136.98 131.14 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.682 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.001 HG13 HD13 ' A' ' 45' ' ' LEU . 6.7 m -98.39 104.59 16.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.436 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -104.6 106.71 17.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.754 HD21 HG13 ' A' ' 52' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.086 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.865 0.364 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.568 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 42.4 t-20 -119.46 127.59 53.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.208 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.97 145.21 26.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.427 0.632 . . . . 0.0 111.576 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.913 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.15 141.8 44.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.841 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.913 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.69 156.72 39.12 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 120.998 0.428 . . . . 0.0 110.575 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.27 114.26 8.24 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.357 0.599 . . . . 0.0 111.32 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.695 HG23 ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -131.82 -170.81 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.936 -179.49 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.695 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -66.67 -71.43 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -160.57 -18.15 0.05 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.6 p -42.85 -38.3 2.12 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.74 0.305 . . . . 0.0 111.813 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.709 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -58.56 -42.1 87.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.755 -179.735 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.55 HD13 HG23 ' A' ' 55' ' ' ILE . 5.4 tp -71.54 -30.3 65.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.415 -179.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.494 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -89.32 -27.97 20.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.588 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -69.82 -46.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.89 0.376 . . . . 0.0 110.637 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 1.001 HD13 HG13 ' A' ' 12' ' ' VAL . 65.7 mt -78.91 -31.57 45.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.176 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.52 ' HB2' HG11 ' A' ' 53' ' ' VAL . 13.1 tttt -83.29 -15.7 49.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.298 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.494 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -48.51 -39.46 23.35 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.683 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -121.01 142.63 35.13 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -84.12 50.7 3.15 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.723 2.282 . . . . 0.0 112.522 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.832 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -97.79 -49.69 4.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.536 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.832 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -125.26 -171.22 2.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.938 179.3 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.754 HG13 HD21 ' A' ' 14' ' ' ASN . 2.6 m -110.71 143.14 21.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 111.927 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.52 HG11 ' HB2' ' A' ' 46' ' ' LYS . 3.2 p -131.43 117.6 36.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.192 178.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.578 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -127.46 135.06 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.068 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.591 HG22 HE22 ' A' ' 41' ' ' GLN . 1.0 OUTLIER -88.63 120.35 37.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.843 179.231 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 70.8 p . . . . . 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.875 -179.981 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.75 HD11 ' O ' ' A' ' 118' ' ' ILE . 18.6 tp . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.824 0.345 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -48.84 -30.39 5.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.741 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 t -62.05 -13.1 22.85 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.584 ' HB3' HD23 ' A' ' 97' ' ' LEU . 22.1 m-85 -108.06 159.87 16.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.633 0.254 . . . . 0.0 110.738 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.621 HG22 HG23 ' A' ' 94' ' ' VAL . 65.2 m -118.38 -97.86 0.46 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.609 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.726 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.2 t -139.05 -52.91 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.059 0 CA-C-O 121.198 0.523 . . . . 0.0 111.347 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -72.74 -19.85 61.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.8 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -80.68 -36.41 32.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 120.852 0.358 . . . . 0.0 110.893 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.726 HD11 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -63.32 -58.35 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.317 0.58 . . . . 0.0 109.981 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.622 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 3.3 ptpt -55.06 -33.59 62.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.335 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.74 -22.01 29.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.066 0.46 . . . . 0.0 111.443 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.423 ' OE1' ' CE1' ' A' ' 92' ' ' PHE . 10.8 mt-30 -87.09 -36.8 17.93 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.907 HD21 HD12 ' A' ' 120' ' ' LEU . 9.0 mt -59.45 -48.68 80.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.199 0.523 . . . . 0.0 110.148 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -37.52 83.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.596 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.14 -6.57 59.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.265 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 -100.12 -15.22 18.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.169 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.55 -2.89 21.8 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.006 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.472 ' HB ' HD22 ' A' ' 101' ' ' LEU . 2.9 mt -109.93 78.38 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.909 0.385 . . . . 0.0 111.113 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.445 HG23 ' O ' ' A' ' 107' ' ' THR . 3.5 t -82.17 90.99 6.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.501 ' HE2' HD12 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.04 -177.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.107 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 9.9 mttm -148.46 -51.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.58 30.25 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.894 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -116.72 -37.48 3.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.497 ' HB3' ' HD2' ' A' ' 108' ' ' PHE . . . -100.99 99.86 10.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.886 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -80.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.241 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.677 ' HA ' HD22 ' A' ' 117' ' ' LEU . 8.3 ptmt -143.01 -38.9 0.34 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.734 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.05 -23.13 38.77 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -85.81 -36.86 19.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.755 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.953 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.0 -22.67 39.24 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.371 -179.419 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.953 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.41 -28.14 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.073 178.644 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.61 -33.17 18.94 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 121.209 0.528 . . . . 0.0 110.826 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.907 HD12 HD21 ' A' ' 101' ' ' LEU . 1.4 tm? -49.12 -51.21 33.32 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.692 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.538 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 40.8 m-85 . . . . . 0 C--N 1.332 -0.194 0 CA-C-O 120.703 0.287 . . . . 0.0 110.982 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.78 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.613 0.244 . . . . 0.0 110.554 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.532 ' CE2' ' NE2' ' A' ' 41' ' ' GLN . 0.5 OUTLIER -144.79 143.53 30.7 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.569 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -89.36 125.12 35.0 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.873 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.731 ' CG1' HD12 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -110.31 149.11 13.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.364 0.602 . . . . 0.0 112.011 -178.395 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.5 p -138.6 126.67 28.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.452 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.051 HG13 HD13 ' A' ' 45' ' ' LEU . 16.9 m -93.82 104.69 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.549 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.88 106.56 18.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.427 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.567 ' ND2' HD12 ' A' ' 51' ' ' LEU . 1.8 t30 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.07 0.462 . . . . 0.0 111.09 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.495 ' HB2' HG22 ' A' ' 11' ' ' VAL . 37.3 p-10 . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 120.921 0.391 . . . . 0.0 111.297 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.8 m-20 -119.16 137.86 53.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.079 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.19 145.08 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.359 0.599 . . . . 0.0 111.484 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.894 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -115.07 143.4 45.25 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.93 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.894 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.33 157.38 37.84 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 121.179 0.514 . . . . 0.0 111.044 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.78 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.56 111.34 5.32 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.686 0.755 . . . . 0.0 111.987 -177.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.726 HG12 ' H ' ' A' ' 38' ' ' SER . 2.3 t -129.93 179.67 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.489 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.726 ' H ' HG12 ' A' ' 37' ' ' VAL . 0.6 OUTLIER -104.79 72.61 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -179.127 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.544 ' HA ' ' NE2' ' A' ' 41' ' ' GLN . 0.4 OUTLIER 78.52 -16.65 0.65 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 178.396 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 t -62.58 -21.37 65.56 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.577 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -84.61 -25.77 28.35 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.376 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.539 HD12 HG22 ' A' ' 53' ' ' VAL . 7.5 tp -74.36 -54.72 7.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.96 0.41 . . . . 0.0 110.977 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.63 -21.48 66.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.184 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -48.38 21.61 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 1.051 HD13 HG13 ' A' ' 12' ' ' VAL . 59.1 mt -78.83 -30.75 45.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.284 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.452 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -77.28 -10.26 59.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.373 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.69 -47.94 29.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.794 0.331 . . . . 0.0 111.44 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.5 123.08 64.8 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -80.6 55.28 5.61 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.579 2.186 . . . . 0.0 112.455 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -135.58 -43.07 0.68 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.704 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -90.97 -176.5 4.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.52 108.83 19.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.775 0.321 . . . . 0.0 111.599 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.539 HG22 HD12 ' A' ' 42' ' ' LEU . 1.8 p -98.93 111.77 29.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.195 0.521 . . . . 0.0 110.295 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.629 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.7 mt-30 -127.04 144.66 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.295 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.492 HG22 HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -100.03 133.13 44.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.353 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.782 179.967 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.527 0.061 0 CA-C-O 120.805 0.336 . . . . 0.0 110.971 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -48.82 -41.79 34.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.341 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.87 -13.78 27.68 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.439 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 6.2 m-85 -106.29 104.53 14.25 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 66.5 p -89.44 -85.54 0.2 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.997 -178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.712 ' HA ' HD22 ' A' ' 97' ' ' LEU . 24.2 t -145.5 -56.52 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.957 0.408 . . . . 0.0 111.309 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -73.44 -19.25 61.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.005 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -81.99 -20.8 37.76 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.734 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.712 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -78.5 -58.27 3.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.656 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.4 ptpt -55.34 -29.66 58.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.345 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.81 -30.32 24.65 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.064 0.459 . . . . 0.0 112.022 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 121' ' ' PHE . 3.9 mm-40 -86.5 -22.02 26.64 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.696 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.796 HD13 ' CD1' ' A' ' 106' ' ' ILE . 1.2 mt -76.87 -42.2 40.81 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.333 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.405 ' HA ' ' CG2' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -64.29 -43.39 94.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.377 179.686 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -6.33 53.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.176 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.469 ' O ' ' HG2' ' A' ' 104' ' ' ARG . 0.7 OUTLIER -108.56 -15.46 14.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.153 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.669 ' O ' HG22 ' A' ' 106' ' ' ILE . . . 144.25 -54.6 0.57 Allowed Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.179 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.951 HD11 ' CD2' ' A' ' 108' ' ' PHE . 9.4 tp 52.27 136.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-O 121.457 0.646 . . . . 0.0 112.725 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 18.1 p -156.36 26.68 0.35 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.545 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.951 ' CD2' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.82 87.52 0.14 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.644 -179.535 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -67.14 70.9 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 51.28 27.3 3.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.6 p -117.43 -29.23 5.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.268 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.752 ' HB3' ' CB ' ' A' ' 108' ' ' PHE . . . -85.22 76.05 10.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.81 0.338 . . . . 0.0 111.386 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -70.59 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.983 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.795 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.1 mttp -154.09 -42.24 0.09 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.73 0.3 . . . . 0.0 111.477 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.29 -23.9 40.39 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.926 0.393 . . . . 0.0 110.143 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.8 mt-10 -85.97 -37.37 19.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.452 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.88 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -77.88 -19.82 54.1 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.913 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.88 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -82.85 -27.85 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.997 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.3 -34.74 18.77 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.84 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 tp -49.9 -40.43 42.97 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.447 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.526 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 6.0 m-85 . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.287 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.842 HG22 ' C ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.675 0.274 . . . . 0.0 110.646 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.504 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.23 144.67 30.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.366 0.603 . . . . 0.0 112.619 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.69 130.06 36.02 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.638 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.737 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.24 152.61 12.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 112.079 -178.557 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.5 p -138.47 102.1 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.316 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.847 HG21 HD13 ' A' ' 45' ' ' LEU . 42.9 t -92.49 130.25 41.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.18 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -125.0 106.62 10.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.866 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.694 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.768 0.318 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.43 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 10.1 m-20 -126.38 131.78 51.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.236 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.4 m -87.22 145.76 26.26 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.167 0.508 . . . . 0.0 111.162 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.946 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -115.34 141.16 48.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.118 -179.847 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.946 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.67 157.3 38.23 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.9 0.381 . . . . 0.0 110.219 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.842 ' C ' HG22 ' A' ' 7' ' ' THR . . . -69.2 114.58 7.59 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.742 0.782 . . . . 0.0 111.352 -177.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 38' ' ' SER . 11.1 t -127.79 167.91 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.775 -179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.542 ' N ' HG12 ' A' ' 37' ' ' VAL . 0.3 OUTLIER -53.39 -53.71 47.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.595 -179.93 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.74 -20.62 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.38 -33.1 0.6 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.825 0.345 . . . . 0.0 111.473 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.616 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.1 -57.85 11.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.771 179.618 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.44 HD13 HG23 ' A' ' 55' ' ' ILE . 8.8 tp -53.05 -55.47 23.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.874 -178.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -67.33 -30.94 70.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -53.08 -54.62 32.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.364 . . . . 0.0 110.661 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.847 HD13 HG21 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -79.07 -54.45 5.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.062 179.783 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.652 ' N ' HG11 ' A' ' 53' ' ' VAL . 11.7 tttt -49.26 -25.94 2.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.511 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -45.19 -30.2 1.13 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.541 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -112.5 121.73 38.17 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.774 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -77.19 69.58 7.05 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.468 2.112 . . . . 0.0 112.266 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.35 -40.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.173 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.711 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -100.22 124.45 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.754 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.501 ' O ' HG13 ' A' ' 12' ' ' VAL . 3.5 t -69.7 106.11 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.999 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.652 HG11 ' N ' ' A' ' 46' ' ' LYS . 2.0 p -107.13 117.73 53.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.703 178.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.727 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.07 142.96 51.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.084 -178.665 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.526 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.2 pt -93.8 126.78 46.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.28 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.59 179.692 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.703 HD12 ' O ' ' A' ' 118' ' ' ILE . 3.0 mm? . . . . . 0 CA--C 1.525 0.018 0 CA-C-O 120.856 0.36 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -54.62 -50.28 68.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.332 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.8 m -62.41 -14.63 42.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.48 ' HB3' HD11 ' A' ' 118' ' ' ILE . 4.3 m-85 -71.75 -14.45 62.01 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 122.24 -0.287 . . . . 0.0 111.26 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.757 ' O ' HD11 ' A' ' 97' ' ' LEU . 0.2 OUTLIER 57.74 -148.72 0.48 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.968 179.293 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.689 ' O ' HD22 ' A' ' 97' ' ' LEU . 4.0 m -127.44 -32.08 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.166 0.508 . . . . 0.0 110.993 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.6 -19.55 38.18 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.441 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -23.6 40.13 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.823 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 1.01 HD13 ' H ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.78 -48.92 8.91 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.18 179.8 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HE3' ' CD2' ' A' ' 117' ' ' LEU . 0.8 OUTLIER -57.89 -35.67 71.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.611 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.16 -23.97 28.15 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.501 ' HG2' ' CE1' ' A' ' 121' ' ' PHE . 1.0 OUTLIER -86.52 -37.89 17.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.664 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.795 HD12 ' CD1' ' A' ' 117' ' ' LEU . 1.9 mt -59.34 -46.98 87.13 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.479 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -59.93 -43.08 95.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.961 179.297 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -72.62 -6.78 46.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.051 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -105.98 -15.43 14.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.87 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 63.05 63.85 4.25 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.725 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.668 ' HB ' HD22 ' A' ' 101' ' ' LEU . 48.5 mm -116.59 -86.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.587 0.194 . . . . 0.0 111.109 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.657 HG22 HG22 ' A' ' 106' ' ' ILE . 1.3 t 169.88 150.13 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.479 ' CZ ' HG23 ' A' ' 102' ' ' THR . 13.4 p90 -171.89 92.27 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.971 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -176.79 135.4 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.883 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 68.84 -67.11 0.22 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.873 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.3 p -65.88 -68.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.71 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.562 ' O ' HG23 ' A' ' 113' ' ' THR . . . -79.98 179.56 7.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.965 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.562 HG23 ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -172.34 -80.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.749 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.407 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -138.21 -57.49 0.65 Allowed 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.422 179.676 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.71 -35.03 79.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.148 0.499 . . . . 0.0 109.954 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -86.84 -33.95 19.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.756 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.795 ' CD1' HD12 ' A' ' 101' ' ' LEU . 1.7 tp -74.67 -37.47 62.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.896 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.703 ' O ' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -77.56 -28.31 15.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.101 179.651 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.75 -32.5 20.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 121.077 0.465 . . . . 0.0 110.872 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.7 mt -54.98 -40.36 69.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.641 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.56 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.4 m-85 . . . . . 0 C--N 1.331 -0.218 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.676 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.867 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.582 0.229 . . . . 0.0 110.785 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.493 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.07 137.12 25.77 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.7 p -87.91 124.41 33.65 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.801 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.02 157.72 10.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 CA-C-O 120.923 0.392 . . . . 0.0 111.385 -178.625 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.4 p -138.51 108.97 4.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.112 0.482 . . . . 0.0 110.537 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.961 HG22 HD13 ' A' ' 45' ' ' LEU . 2.5 t -92.68 135.9 26.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.23 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -116.72 113.34 22.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.757 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.522 ' HB3' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-O 121.039 0.447 . . . . 0.0 110.951 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.773 0.321 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.407 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.5 p30 -114.73 123.39 49.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.848 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -87.44 145.73 26.15 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.331 0.586 . . . . 0.0 111.629 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.951 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.5 OUTLIER -114.91 139.08 50.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.945 179.671 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.951 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.8 156.4 39.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.867 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.63 116.73 11.29 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.415 0.626 . . . . 0.0 111.384 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.66 HG23 ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -130.19 -171.69 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.849 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.66 ' N ' HG23 ' A' ' 37' ' ' VAL . 44.3 p -59.77 -58.63 7.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.172 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 179.88 -16.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.4 t -42.54 -34.76 0.91 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.655 HE22 HG21 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -58.9 -48.75 80.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.843 0.354 . . . . 0.0 111.356 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.526 HD13 HG21 ' A' ' 55' ' ' ILE . 9.3 tp -55.55 -50.11 70.91 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.406 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -77.25 -29.67 54.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.444 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -58.59 -46.57 86.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.119 0.485 . . . . 0.0 110.15 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.961 HD13 HG22 ' A' ' 12' ' ' VAL . 4.5 mt -78.95 -48.15 15.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.704 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.418 ' CA ' HG11 ' A' ' 53' ' ' VAL . 1.5 ttmm -64.12 -16.72 62.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.291 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.53 -41.94 14.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.807 0.337 . . . . 0.0 111.462 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.83 121.37 51.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.84 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.54 62.6 6.33 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.57 2.18 . . . . 0.0 112.3 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.78 -46.14 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 14' ' ' ASN . 44.6 mt -92.26 144.49 25.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.993 0.425 . . . . 0.0 111.187 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.69 108.18 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.935 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.623 HG23 HD12 ' A' ' 45' ' ' LEU . 1.3 p -104.66 121.39 56.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.971 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.705 ' O ' HG22 ' A' ' 10' ' ' VAL . 9.0 pm0 -126.92 133.39 50.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.635 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.66 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -97.98 131.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.446 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.3 m . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.459 179.523 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.473 HD12 HD11 ' A' ' 118' ' ' ILE . 4.1 mm? . . . . . 0 CA--C 1.528 0.114 0 CA-C-O 120.617 0.246 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -49.06 -50.29 37.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.393 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 t -62.19 -15.08 44.09 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -114.22 103.5 11.16 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.697 0.284 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.445 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -94.55 -80.87 0.4 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.593 -179.579 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.753 ' HA ' HD22 ' A' ' 97' ' ' LEU . 28.1 t -147.33 -56.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.81 0.338 . . . . 0.0 111.302 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -19.59 60.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.981 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -82.65 -21.28 35.05 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.514 -179.362 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.753 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -75.6 -58.47 3.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -57.12 -29.13 63.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.29 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.9 23.95 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 7.3 mm-40 -84.17 -28.01 27.67 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.216 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.944 HD22 ' HA ' ' A' ' 106' ' ' ILE . 1.1 mt -69.78 -45.73 67.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.849 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.489 ' HA ' ' HB ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -57.33 -45.29 84.4 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.373 179.541 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -75.52 -6.32 49.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.413 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -114.76 24.17 12.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.599 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.61 -32.09 6.87 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.743 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.944 ' HA ' HD22 ' A' ' 101' ' ' LEU . 0.5 OUTLIER 43.9 96.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 112.106 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -118.16 28.23 8.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.512 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.917 ' CE2' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -69.34 -177.74 1.21 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.096 -179.79 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.43 165.91 12.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.96 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -26.12 42.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.943 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -82.58 0.89 40.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.387 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.82 77.53 0.08 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.785 0.326 . . . . 0.0 111.005 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 70.5 p -77.05 -79.75 0.11 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.979 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.722 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.1 pptp? -146.55 -39.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.667 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.412 ' HA ' HG22 ' A' ' 118' ' ' ILE . . . -80.82 -23.75 38.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.94 0.4 . . . . 0.0 110.714 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -85.92 -37.2 19.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.502 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.891 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.65 -19.33 41.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.947 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.891 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.48 -26.27 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.101 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.52 -34.31 20.04 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.819 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.98 -41.57 64.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.077 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.493 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 4.6 m-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.42 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.497 -0.241 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.35 154.97 51.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.831 0.348 . . . . 0.0 110.979 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -152.64 165.57 34.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.794 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.8 mtp 58.93 29.95 19.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.9 p-10 -165.43 152.92 10.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.907 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.59 79.15 1.19 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.994 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.811 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 6.3 t -112.37 130.25 56.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.782 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.82 152.99 38.59 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -98.88 122.93 42.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.727 HG11 HD12 ' A' ' 45' ' ' LEU . 0.4 OUTLIER -110.22 155.63 11.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.007 0.432 . . . . 0.0 111.873 -178.47 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -135.71 134.91 51.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.113 0.482 . . . . 0.0 111.201 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.811 HG13 HD13 ' A' ' 45' ' ' LEU . 14.1 m -102.36 107.52 22.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.039 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.72 106.46 18.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.613 HD21 ' HB ' ' A' ' 16' ' ' ILE . 53.8 t30 -115.84 146.61 41.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.371 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.658 ' HA ' HD11 ' A' ' 29' ' ' LEU . 15.0 ttt180 -130.08 35.87 4.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.321 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.682 HG22 ' HG2' ' A' ' 17' ' ' LYS . 15.9 mt -84.72 -83.38 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.03 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.847 ' HA ' HD22 ' A' ' 29' ' ' LEU . 7.7 ptpt -158.57 -174.64 4.88 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -102.89 31.57 4.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.909 0.385 . . . . 0.0 110.612 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -153.29 22.61 0.76 Allowed Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.753 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.504 ' CZ ' ' HB3' ' A' ' 27' ' ' PHE . 32.2 p90 -76.79 -17.15 59.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.768 0.318 . . . . 0.0 110.557 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 mmt-85 56.89 -174.46 0.07 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.347 0.594 . . . . 0.0 112.007 178.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.451 ' HG3' ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -169.68 -155.14 0.13 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.174 179.464 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.623 ' HB3' ' HE2' ' A' ' 25' ' ' PHE . . . -42.46 -29.91 0.31 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.722 0.296 . . . . 0.0 111.675 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.36 45.07 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.17 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.623 ' HE2' ' HB3' ' A' ' 23' ' ' ALA . 40.8 m-85 -128.67 21.95 5.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.658 0.266 . . . . 0.0 111.283 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 48.08 45.25 19.47 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.002 0.429 . . . . 0.0 110.946 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 20' ' ' TYR . 3.3 m-30 -49.16 115.55 1.34 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.242 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -87.7 172.17 9.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.089 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.847 HD22 ' HA ' ' A' ' 17' ' ' LYS . 2.4 tp -75.11 100.46 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.685 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 165.69 -152.71 22.23 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.589 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER -109.29 129.1 55.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.872 0.368 . . . . 0.0 111.01 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.557 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.7 t-20 -116.36 130.53 56.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.1 m -86.96 145.14 26.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.455 0.645 . . . . 0.0 111.625 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.942 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.41 142.14 44.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.865 179.717 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.942 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.34 157.56 37.53 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.11 0.481 . . . . 0.0 110.773 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.811 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -69.2 105.15 2.4 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.764 0.792 . . . . 0.0 111.095 -177.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 35' ' ' ALA . 5.6 t -123.66 166.48 18.68 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.047 0 CA-C-N 114.205 -1.362 . . . . 0.0 110.617 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.491 ' N ' HG12 ' A' ' 37' ' ' VAL . 11.3 t -52.09 -73.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.351 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -156.5 -16.69 0.1 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -43.03 -45.88 5.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.879 0.371 . . . . 0.0 111.408 -179.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.627 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -44.24 -60.92 1.69 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.204 179.562 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD13 HG23 ' A' ' 55' ' ' ILE . 11.4 tp -52.01 -55.38 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.784 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -35.07 79.08 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' SER . 2.6 tp60 -68.2 -41.8 80.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.852 0.358 . . . . 0.0 111.061 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.811 HD13 HG13 ' A' ' 12' ' ' VAL . 68.2 mt -78.74 -31.24 46.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.61 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -79.64 -29.8 41.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 110.865 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.53 -29.7 59.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.185 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -93.19 110.15 44.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.764 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.85 58.78 6.62 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.514 2.143 . . . . 0.0 112.418 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.59 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER -140.97 -45.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.59 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.2 OUTLIER -107.75 175.35 5.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.545 179.796 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.604 ' O ' HG12 ' A' ' 12' ' ' VAL . 2.9 m -110.67 146.04 16.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.96 0.41 . . . . 0.0 111.984 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.457 HG21 ' HA ' ' A' ' 42' ' ' LEU . 3.2 p -130.82 116.32 33.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.818 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.644 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.0 mm-40 -127.47 131.43 50.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.48 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.633 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.8 pt -88.75 132.3 33.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.586 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 39.1 p -122.26 104.5 9.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.489 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -104.89 92.72 4.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.986 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 58' ' ' THR . 8.6 t -68.33 83.08 0.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 141.57 44.02 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.526 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.0 p -178.52 99.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.76 0.314 . . . . 0.0 110.858 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -98.55 34.25 2.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.907 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.09 148.01 29.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.872 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 109.99 -102.76 1.61 Allowed Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.488 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.39 -35.53 4.33 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.476 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 60.72 111.28 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.867 0.365 . . . . 0.0 110.889 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -96.62 28.48 13.27 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.478 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.19 104.55 14.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.807 0.337 . . . . 0.0 110.857 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.7 m -89.3 -46.8 8.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.886 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -71.56 165.89 22.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.886 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.42 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 1.2 tm-20 178.19 -53.21 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.907 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.42 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 48.8 Cg_exo -55.95 -43.9 52.39 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.44 2.093 . . . . 0.0 112.193 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -86.15 167.13 15.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.085 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 129.96 99.61 0.88 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.467 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 t 60.58 80.18 0.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.816 0.341 . . . . 0.0 110.875 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -84.97 129.13 34.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.919 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.29 -44.4 2.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.786 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -137.59 132.38 33.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.911 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.4 mttt -157.7 -65.07 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.92 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 60.85 92.89 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.824 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mp 64.45 -79.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.827 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.12 92.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.1 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -167.59 -56.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.09 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -141.19 138.0 17.35 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.816 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.52 134.57 33.5 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.41 2.073 . . . . 0.0 112.214 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -53.28 -61.8 0.42 Allowed 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.356 2.037 . . . . 0.0 112.314 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m 60.25 31.39 20.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.893 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.8 m -125.09 79.11 1.77 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.957 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -141.78 -61.39 0.46 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.718 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.5 tp -74.87 -31.56 61.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.713 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -44.09 41.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.556 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.88 -14.87 38.01 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -93.66 104.19 16.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.825 0.345 . . . . 0.0 110.521 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.523 HG22 HG23 ' A' ' 94' ' ' VAL . 68.0 m -79.94 -97.61 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.458 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.623 ' HA ' HD11 ' A' ' 97' ' ' LEU . 20.5 t -142.89 -41.85 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.942 0.401 . . . . 0.0 111.246 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -77.77 -20.88 52.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.618 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.89 -51.01 24.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.221 0.534 . . . . 0.0 109.912 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.657 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -50.86 -58.3 6.32 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.904 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.554 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 3.4 ptpt -56.87 -33.31 66.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.727 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.1 -24.15 28.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.982 0.42 . . . . 0.0 112.004 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.478 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 1.3 tp60 -87.09 -37.8 17.08 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.589 HD11 HD22 ' A' ' 120' ' ' LEU . 1.2 mt -60.07 -46.94 87.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.033 0.444 . . . . 0.0 110.081 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -39.83 90.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.179 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.12 -6.58 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.125 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -101.75 -15.34 17.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.14 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.29 39.2 3.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.58 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.443 ' HB ' HD22 ' A' ' 101' ' ' LEU . 29.6 mt -141.58 85.08 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.762 0.315 . . . . 0.0 111.169 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.6 t -62.08 157.92 17.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.883 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.823 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.0 p90 -152.39 101.13 2.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.971 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.51 -52.49 2.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.823 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -83.16 -59.1 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.767 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.1 t -88.08 -167.83 2.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.717 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.823 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . 54.65 48.71 19.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.031 0.444 . . . . 0.0 111.087 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.32 -70.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.657 ' HE3' ' HB2' ' A' ' 115' ' ' ALA . 0.0 OUTLIER -157.53 -39.87 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.328 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.657 ' HB2' ' HE3' ' A' ' 114' ' ' LYS . . . -83.12 -21.47 33.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.003 0.43 . . . . 0.0 109.993 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 9.5 mm-40 -85.84 -38.79 17.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.658 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.804 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -78.06 -20.14 52.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.611 -0.435 . . . . 0.0 111.524 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.804 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -28.0 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.779 177.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.58 -31.81 19.66 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.18 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.589 HD22 HD11 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -49.05 -53.11 21.71 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.147 -178.751 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.556 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 88.5 m-85 -55.28 85.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 111.416 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -128.61 131.7 23.92 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.074 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.54 90.33 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.422 2.082 . . . . 0.0 112.321 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -153.6 37.87 0.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.07 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.27 103.56 9.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.881 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 163.77 -81.45 0.12 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.507 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -149.18 -56.78 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.784 0.326 . . . . 0.0 110.853 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -165.73 75.64 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.874 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 11.5 m -90.8 156.81 17.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -130.61 84.25 2.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.877 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.051 179.984 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.531 -0.228 . . . . 0.0 112.531 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 p -109.43 -13.44 14.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.646 0.26 . . . . 0.0 111.307 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 64.22 -174.16 0.17 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.805 0.336 . . . . 0.0 110.867 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 67.78 27.84 7.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 57.71 106.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.945 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.11 124.98 4.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.957 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.902 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 2.0 t -135.64 130.89 35.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.813 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.56 ' CE2' ' HB ' ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.52 145.61 30.22 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.0 p -123.56 121.19 35.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.944 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.874 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.75 152.43 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 111.915 -178.532 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.6 p -127.43 137.31 58.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.68 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.749 ' CG1' HD13 ' A' ' 45' ' ' LEU . 15.7 m -110.78 104.65 17.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -90.66 106.33 18.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.748 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -96.83 145.45 25.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.026 0.441 . . . . 0.0 111.535 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HA ' HD21 ' A' ' 29' ' ' LEU . 2.7 mmt180 -146.85 35.29 0.93 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.268 179.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.1 mt -101.12 -54.44 6.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.357 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.0 ptmt -153.62 -96.69 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.096 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -137.43 50.36 1.97 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.079 0.466 . . . . 0.0 109.905 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.484 ' O ' ' HB3' ' A' ' 20' ' ' TYR . . . 113.82 -66.4 0.27 Allowed Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.197 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.484 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 53.8 t80 79.98 -20.28 0.39 Allowed 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 122.544 0.338 . . . . 0.0 111.642 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.482 ' HD2' HD11 ' A' ' 51' ' ' LEU . 0.0 OUTLIER 165.16 167.9 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.921 0.391 . . . . 0.0 111.28 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.416 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 2.0 ttt180 173.19 -80.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.2 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.37 17.36 23.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.71 26.56 5.27 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.732 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.4 153.68 11.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.613 0.244 . . . . 0.0 110.373 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.31 100.08 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 110.637 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' O ' ' CG ' ' A' ' 28' ' ' HIS . 2.7 t80 -55.65 -107.55 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.056 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.531 ' CG ' ' O ' ' A' ' 27' ' ' PHE . 96.8 m-70 -163.73 170.0 17.62 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.894 0.378 . . . . 0.0 110.722 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -91.3 107.03 18.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.429 179.075 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 166.06 -142.45 7.67 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.19 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.434 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -143.35 131.5 21.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.893 0.377 . . . . 0.0 111.329 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.503 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 2.3 t-20 -124.06 138.27 54.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.08 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.07 145.05 26.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.361 0.601 . . . . 0.0 111.511 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.959 HD22 ' H ' ' A' ' 35' ' ' ALA . 1.6 tm? -101.29 150.91 22.5 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.643 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.959 ' H ' HD22 ' A' ' 34' ' ' LEU . . . -70.73 156.64 39.25 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 121.742 0.782 . . . . 0.0 112.828 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.902 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.18 105.02 3.26 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.924 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.703 ' O ' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -123.46 -170.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.955 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.613 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.8 p -85.66 43.01 1.0 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.809 ' OE1' HD23 ' A' ' 42' ' ' LEU . 0.0 OUTLIER 79.23 -16.51 0.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.069 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -44.85 -34.15 2.23 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.125 0.488 . . . . 0.0 110.586 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.582 ' OE1' ' HB ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -56.99 -44.24 82.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.258 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.809 HD23 ' OE1' ' A' ' 39' ' ' GLU . 13.9 tp -56.46 -55.63 31.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.147 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -26.18 55.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.557 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -49.4 75.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.821 0.343 . . . . 0.0 110.594 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.77 HD12 HG11 ' A' ' 10' ' ' VAL . 11.4 mt -79.06 -46.55 17.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.266 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.545 ' CA ' HG11 ' A' ' 53' ' ' VAL . 1.7 tttp -54.93 -22.56 15.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.346 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.01 -70.77 0.09 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.639 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -64.07 117.2 33.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.858 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -80.57 87.27 1.53 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.509 2.14 . . . . 0.0 112.546 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.436 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 1.1 tpt180 -168.15 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.917 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.627 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -93.87 174.85 6.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.505 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -115.91 106.86 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.279 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.545 HG11 ' CA ' ' A' ' 46' ' ' LYS . 2.1 p -99.02 115.71 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.54 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.656 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.8 tp60 -108.77 130.36 55.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.823 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.874 HG22 HG23 ' A' ' 10' ' ' VAL . 1.3 pp -107.64 105.48 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.721 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.94 104.63 9.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.761 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.474 ' HB2' ' CE2' ' A' ' 8' ' ' PHE . 2.3 tm-20 -128.12 64.67 1.39 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.904 0.383 . . . . 0.0 111.032 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.8 t -154.85 39.14 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -129.31 178.56 17.28 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.512 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.2 t -107.27 -19.89 13.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.722 0.296 . . . . 0.0 111.171 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 67.44 94.86 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.89 0.376 . . . . 0.0 110.895 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -96.28 41.66 1.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.895 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 163.92 124.6 0.72 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.518 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.33 -74.85 0.34 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.458 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 60.91 100.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.831 0.348 . . . . 0.0 110.879 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 160.97 127.05 0.86 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.552 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.87 130.87 47.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.83 0.348 . . . . 0.0 110.828 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.1 t -119.09 -37.95 3.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.052 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.83 161.94 0.13 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.839 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 4.4 mm-40 -91.38 140.48 25.54 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.971 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 70' ' ' GLU . 41.1 Cg_exo -56.68 -163.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.466 2.111 . . . . 0.0 112.337 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 58.79 -177.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.121 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 147.31 59.74 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.525 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.4 m -126.33 -177.66 4.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.828 0.347 . . . . 0.0 110.878 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -94.74 -65.63 0.97 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.948 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -90.55 116.4 28.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.867 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -164.7 100.44 0.79 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.933 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -176.13 -45.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.89 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.58 121.81 23.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.577 ' O ' HD12 ' A' ' 80' ' ' LEU . 1.4 pp -153.63 129.19 9.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.911 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -162.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.689 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -122.45 -39.59 2.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.325 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.507 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 5.1 m-20 -81.03 -68.93 0.2 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.33 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.507 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 7.9 Cg_exo -40.45 -48.5 4.22 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.693 2.262 . . . . 0.0 112.745 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.456 ' HD3' ' CG ' ' A' ' 84' ' ' PRO . 21.8 Cg_exo -64.93 159.66 45.04 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.399 2.066 . . . . 0.0 112.142 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 54.77 79.04 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.013 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 75.3 p -85.88 -78.1 0.28 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.846 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.46 -54.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.674 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.905 HD21 HG12 ' A' ' 118' ' ' ILE . 18.9 tp -79.01 -25.65 43.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.015 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -49.04 -47.6 44.55 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.532 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.08 -13.06 22.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.691 ' HB2' HD12 ' A' ' 89' ' ' LEU . 42.9 m-85 -94.66 -20.9 19.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 120.644 0.259 . . . . 0.0 111.18 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.772 ' O ' HD21 ' A' ' 97' ' ' LEU . 1.6 p 61.13 -147.92 0.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.953 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.684 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.5 t -120.34 -54.92 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.073 0 CA-C-O 121.012 0.434 . . . . 0.0 111.512 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -65.08 -19.96 66.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.971 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.7 OUTLIER -76.33 -37.88 56.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 120.774 0.321 . . . . 0.0 110.784 -178.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 1.006 HD11 HD12 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -64.04 -58.5 6.49 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.766 179.553 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HD2' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -54.23 -35.07 62.04 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.976 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.03 -23.66 28.51 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.43 ' O ' ' N ' ' A' ' 104' ' ' ARG . 6.2 mm-40 -86.78 -39.96 15.44 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.666 HD13 HG21 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -55.94 -48.78 75.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.194 0.521 . . . . 0.0 109.945 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.553 HG23 ' CD1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -64.03 -40.59 96.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.422 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -80.38 -6.35 57.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.433 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.495 ' HB3' HD13 ' A' ' 106' ' ' ILE . 5.0 ttt180 -97.87 -15.45 20.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.307 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 108.62 15.08 14.15 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.274 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.666 HG21 HD13 ' A' ' 101' ' ' LEU . 2.8 mp -96.3 -30.88 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.111 0.456 . . . . 0.0 110.758 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.7 p 47.29 28.54 1.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.614 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.553 ' CD1' HG23 ' A' ' 102' ' ' THR . 1.1 m-85 60.62 -174.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.525 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.47 ' N ' ' HB3' ' A' ' 112' ' ' ALA . 4.9 mmtp -177.46 173.82 1.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.889 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -31.06 60.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.82 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.32 -29.94 14.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.643 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.47 ' HB3' ' N ' ' A' ' 109' ' ' LYS . . . -80.99 58.82 3.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.06 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -70.69 -66.51 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.445 ' HA ' HD21 ' A' ' 117' ' ' LEU . 10.4 ptpp? -159.0 -45.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.61 -21.64 59.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.912 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 64.1 mm-40 -85.16 -37.52 20.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.997 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.91 HD12 ' N ' ' A' ' 118' ' ' ILE . 4.0 pp -71.23 -38.03 71.98 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.001 0.429 . . . . 0.0 110.382 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 1.006 HD12 HD11 ' A' ' 97' ' ' LEU . 1.7 tt -70.03 -26.56 30.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.121 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.92 -33.47 19.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.077 0.465 . . . . 0.0 111.173 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -64.16 -36.0 82.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.839 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 5.8 m-85 -63.95 82.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.913 0.387 . . . . 0.0 111.277 -179.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -134.19 154.07 79.85 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.904 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.05 73.85 0.35 Allowed 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.51 2.14 . . . . 0.0 112.307 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -133.65 -46.58 0.81 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.155 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -64.47 166.36 8.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.946 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -76.27 -47.78 10.37 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.52 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -62.39 147.45 48.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.83 0.348 . . . . 0.0 110.807 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.45 157.0 17.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.85 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.25 109.04 2.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.877 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -76.51 -41.56 46.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.147 -179.994 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.6 p -178.21 108.36 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.76 0.314 . . . . 0.0 110.785 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -156.95 89.25 1.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.154 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 5.0 mtm -72.86 -74.46 0.17 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.468 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.66 176.57 8.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.16 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -177.37 109.91 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.789 0.328 . . . . 0.0 111.715 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.744 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 6.4 t -153.0 129.34 10.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.261 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.524 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.87 153.66 39.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.546 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 18.6 p -92.38 124.86 36.74 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.655 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 154.25 11.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.044 0.449 . . . . 0.0 111.334 -178.591 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.796 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.26 128.56 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 121.095 0.474 . . . . 0.0 112.035 -179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.017 HG13 HD13 ' A' ' 45' ' ' LEU . 1.7 m -96.92 104.53 15.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.773 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -107.96 106.58 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.621 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.695 ' HB3' HD23 ' A' ' 29' ' ' LEU . 1.3 m120 -136.8 146.6 45.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 0.0 110.938 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -134.03 87.83 2.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.702 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.5 mt -128.56 -59.19 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.481 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.41 6.31 1.89 Allowed 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 50.57 26.52 2.46 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.928 0.394 . . . . 0.0 110.931 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 176.2 67.77 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.902 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.421 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.3 t80 -103.63 28.53 6.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.839 0.352 . . . . 0.0 111.073 -179.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' O ' ' CD1' ' A' ' 27' ' ' PHE . 6.9 mmt85 59.08 176.29 0.07 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.482 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.702 ' NH2' HD23 ' A' ' 45' ' ' LEU . 3.3 tpt180 -177.83 -89.31 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.723 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.78 -34.39 18.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.238 0.542 . . . . 0.0 110.516 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 160.14 41.43 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.116 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.438 ' CE1' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -166.49 169.22 14.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.575 -0.312 . . . . 0.0 110.53 -179.091 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.93 64.23 4.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.651 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.438 ' HB3' ' CE1' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -52.82 127.75 24.48 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.736 -179.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -70.8 108.77 4.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.896 0.379 . . . . 0.0 110.483 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.695 HD23 ' HB3' ' A' ' 14' ' ' ASN . 7.5 mp -46.95 -29.25 1.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.153 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -45.35 169.26 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.752 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -54.67 119.22 5.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.186 0.517 . . . . 0.0 111.997 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.796 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 t-20 -122.05 127.89 50.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.473 -0.785 . . . . 0.0 108.926 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 p -86.43 145.46 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.718 0.771 . . . . 0.0 112.653 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.915 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -122.09 141.33 51.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.504 -1.226 . . . . 0.0 110.149 179.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.915 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -71.16 155.92 40.18 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.141 0.496 . . . . 0.0 110.923 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.744 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.13 109.88 5.47 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.418 0.627 . . . . 0.0 111.838 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 38' ' ' SER . 0.7 OUTLIER -129.13 179.42 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.065 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.809 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.65 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.6 OUTLIER -51.22 -83.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.303 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.448 ' HA ' ' NE2' ' A' ' 41' ' ' GLN . 3.9 tt0 -148.02 -16.57 0.35 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.52 -47.31 5.1 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.626 ' HG3' HG22 ' A' ' 37' ' ' VAL . 1.2 pp0? -52.23 -27.69 15.75 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.44 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.3 tp -81.81 -39.8 23.48 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.843 0.354 . . . . 0.0 110.846 -179.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -83.3 -21.46 33.23 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.422 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -70.5 -49.96 42.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.894 0.378 . . . . 0.0 110.563 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 1.017 HD13 HG13 ' A' ' 12' ' ' VAL . 35.5 mt -78.79 -36.64 42.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.947 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.555 ' N ' HG11 ' A' ' 53' ' ' VAL . 7.4 tttm -67.37 -28.57 68.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.863 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -48.79 -28.3 3.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.228 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -101.97 104.41 35.75 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.761 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.78 66.43 4.86 Favored 'Trans proline' 0 N--CA 1.464 -0.246 0 C-N-CA 122.486 2.124 . . . . 0.0 112.246 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.548 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -145.48 -39.1 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.309 -179.753 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.732 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -102.83 -167.29 1.37 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.669 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.13 106.75 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.908 0.385 . . . . 0.0 111.883 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.555 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.6 p -103.21 111.74 34.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.12 178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.641 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.27 144.85 50.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.528 -179.034 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.655 HG22 HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -103.9 128.56 57.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.181 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 62.4 p -122.43 104.63 9.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.772 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -94.89 78.66 3.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.789 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -112.23 -179.85 3.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.955 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 147.45 -138.95 7.51 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.369 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 m -86.7 154.7 20.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.774 0.321 . . . . 0.0 110.884 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -69.88 78.4 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.933 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -80.15 147.12 31.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.964 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 83.06 -151.56 28.79 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.488 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.49 -65.09 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.485 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -123.38 120.38 32.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.882 0.372 . . . . 0.0 110.926 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 153.02 -75.24 0.24 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.42 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 mp -81.69 122.0 27.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.797 0.332 . . . . 0.0 110.842 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 t -157.19 136.88 12.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.956 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt 60.65 102.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.928 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.634 ' HB2' ' HD3' ' A' ' 71' ' ' PRO . 17.4 mt-10 -156.01 -53.16 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.479 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.634 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 32.0 Cg_exo -62.16 176.94 1.27 Allowed 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.171 1.914 . . . . 0.0 112.241 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 61.03 30.63 19.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.12 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -84.51 92.22 1.71 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.486 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 p -175.98 -44.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.821 0.344 . . . . 0.0 110.818 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -110.62 -32.48 6.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -76.67 -55.13 5.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.88 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -59.84 -50.77 72.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.914 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -84.04 137.84 33.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.776 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -132.41 154.5 49.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.947 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.52 -53.09 4.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.869 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.65 49.89 9.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.863 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -154.65 -68.43 0.13 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.202 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.465 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 1.0 OUTLIER -70.28 -65.28 1.11 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.113 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.465 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 2.4 Cg_endo -43.26 -57.84 1.61 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.705 2.27 . . . . 0.0 112.715 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.461 ' HD3' ' HG2' ' A' ' 84' ' ' PRO . 60.3 Cg_endo -71.92 -167.92 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.39 2.06 . . . . 0.0 112.372 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.22 161.15 14.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.802 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -138.79 126.46 22.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.923 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 60.28 176.65 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.938 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.7 tp 70.07 -56.75 0.58 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.421 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -49.05 -49.49 41.1 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.801 0.334 . . . . 0.0 111.256 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -13.87 32.61 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HB3' ' CD1' ' A' ' 118' ' ' ILE . 2.5 m-85 -79.23 139.31 37.95 Favored 'General case' 0 C--O 1.231 0.127 0 O-C-N 122.196 -0.315 . . . . 0.0 110.604 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -127.93 -70.21 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.221 -179.832 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.572 ' HA ' HD11 ' A' ' 97' ' ' LEU . 39.9 t -153.27 -44.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.004 0.431 . . . . 0.0 111.405 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -20.69 38.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.642 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -76.1 -45.01 36.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 -179.334 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.835 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -59.32 -59.61 5.18 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.396 0.617 . . . . 0.0 110.27 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.491 ' HE3' HD21 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -58.29 -30.74 66.86 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.02 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.66 -21.4 30.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.598 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.452 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 0.0 OUTLIER -85.0 -37.55 20.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.579 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.572 ' HG ' ' CZ ' ' A' ' 121' ' ' PHE . 5.0 mt -64.57 -45.49 86.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 109.573 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.401 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.6 OUTLIER -63.59 -40.34 96.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.857 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -77.31 -6.73 54.31 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.249 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -102.01 -15.22 16.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.024 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 77.91 61.42 2.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.376 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 106' ' ' ILE . 6.3 tt -151.66 93.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.785 0.326 . . . . 0.0 111.142 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.01 140.93 6.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.068 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.571 ' CD1' ' N ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -121.9 -86.41 0.65 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.779 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 51.84 103.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.802 0.334 . . . . 0.0 111.346 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 64.04 178.22 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.411 . . . . 0.0 111.009 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . 0.533 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 2.4 m 56.46 23.01 7.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.037 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 111' ' ' SER . . . 168.14 75.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.04 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.75 -81.55 0.05 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.731 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.727 ' O ' HG22 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -131.88 -57.47 0.98 Allowed 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.57 74.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 0.0 110.737 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -86.18 -33.54 20.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.359 0.599 . . . . 0.0 110.369 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.638 ' CD2' HD13 ' A' ' 97' ' ' LEU . 7.8 tp -78.09 -21.54 50.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.994 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.835 ' HA ' HD22 ' A' ' 97' ' ' LEU . 2.4 tp -82.77 -29.66 8.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.55 -31.02 21.46 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.71 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.2 tp -49.23 -45.1 44.1 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.07 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CZ ' ' HG ' ' A' ' 101' ' ' LEU . 48.8 m-85 -62.63 81.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.368 . . . . 0.0 110.953 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -120.84 102.99 43.75 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.129 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -49.86 -25.8 12.63 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.434 2.089 . . . . 0.0 112.382 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -56.55 154.75 8.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -94.99 152.61 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.996 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -132.36 -99.92 0.76 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.46 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -142.59 -168.37 2.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 110.988 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.91 113.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.957 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 28.7 t -154.28 -48.06 0.09 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -110.16 163.17 13.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.102 179.975 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.519 -0.232 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.3 134.64 33.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.764 0.316 . . . . 0.0 110.984 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -121.81 -172.1 2.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.7 mtt -75.36 -77.09 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.88 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -94.68 157.27 16.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.821 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -148.01 134.27 19.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.967 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.895 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -117.17 140.49 49.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.659 179.947 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.06 145.24 31.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.322 0.582 . . . . 0.0 112.535 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 14.5 p -92.75 126.52 37.87 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -109.95 153.59 11.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.459 -178.503 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.1 p -138.51 126.9 29.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 0.0 111.623 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.77 HG13 HD13 ' A' ' 45' ' ' LEU . 7.7 m -95.74 104.44 15.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.289 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -99.52 106.56 18.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.614 ' OD1' HD12 ' A' ' 16' ' ' ILE . 1.8 t30 -126.41 135.9 51.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.815 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.79 16.89 15.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.951 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.674 HG22 ' N ' ' A' ' 17' ' ' LYS . 1.5 mt -59.9 -70.55 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.843 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.674 ' N ' HG22 ' A' ' 16' ' ' ILE . 7.7 pttm -167.0 -173.77 2.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.902 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.447 ' HA ' ' HA ' ' A' ' 28' ' ' HIS . 15.8 pt-20 -96.0 -14.3 23.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.686 0.279 . . . . 0.0 111.526 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -105.57 54.6 0.59 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.422 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.589 ' CD2' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -117.25 13.33 14.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.758 0.313 . . . . 0.0 111.565 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 60.69 -175.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.33 0.586 . . . . 0.0 112.123 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.449 ' CD ' ' HB2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -173.53 -161.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.058 179.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -48.94 -26.81 2.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.014 0.435 . . . . 0.0 110.942 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 146.23 37.07 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.225 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.479 ' CD1' ' N ' ' A' ' 25' ' ' PHE . 0.9 OUTLIER -142.07 26.04 1.88 Allowed 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.38 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 42.1 53.93 4.2 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.905 0.383 . . . . 0.0 111.425 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.449 ' HB2' ' CD ' ' A' ' 22' ' ' ARG . 3.5 t80 -57.24 153.22 12.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.998 -179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 18' ' ' GLU . 9.6 m170 -103.15 172.61 6.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.12 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.437 ' H ' HD23 ' A' ' 29' ' ' LEU . 0.5 OUTLIER -63.8 74.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.888 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 28' ' ' HIS . . . -144.0 -143.47 4.07 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.425 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.463 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 3.5 p-10 -137.1 132.18 33.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.919 0.39 . . . . 0.0 111.454 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.503 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 13.6 t-20 -122.24 133.83 54.7 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.054 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.6 m -87.1 145.42 26.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 111.63 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.914 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.84 142.18 44.53 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.998 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.914 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.4 157.58 37.53 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.33 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.23 113.05 6.22 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.688 0.756 . . . . 0.0 111.155 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.611 HG12 ' H ' ' A' ' 38' ' ' SER . 2.8 t -129.28 171.71 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.708 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.611 ' H ' HG12 ' A' ' 37' ' ' VAL . 42.7 m -56.38 -72.55 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.16 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.5 -16.67 0.11 Allowed 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 p -46.21 -41.09 12.32 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -57.72 -28.56 63.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 46' ' ' LYS . 10.6 tp -78.45 -50.59 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.0 110.8 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.53 -22.35 59.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.496 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -66.85 -44.56 80.71 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.934 0.397 . . . . 0.0 110.371 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.851 HD12 HG23 ' A' ' 53' ' ' VAL . 18.0 mt -78.88 -54.08 6.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.379 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 2.5 mttp -45.59 -28.75 1.02 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.469 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.82 -27.51 5.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.305 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.57 94.13 48.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.5 -21.27 18.08 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.733 2.289 . . . . 0.0 112.712 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.581 ' C ' HD13 ' A' ' 51' ' ' LEU . 9.1 ttm180 -47.65 -39.7 17.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.49 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.754 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -107.28 -165.22 1.04 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.519 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.59 140.75 48.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.747 0.308 . . . . 0.0 111.514 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.851 HG23 HD12 ' A' ' 45' ' ' LEU . 3.3 p -132.22 116.81 30.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.896 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.529 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.5 mt-30 -127.63 133.19 49.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.653 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.477 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -93.93 130.67 42.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.966 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.0 p -122.36 104.67 9.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.785 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -156.11 -72.68 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.005 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.0 p 55.95 171.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.961 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 166.44 50.14 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.584 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.0 p -115.13 -59.76 1.97 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.346 . . . . 0.0 110.971 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.75 165.04 11.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.81 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -131.54 90.38 2.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.823 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 123.37 -58.4 0.63 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.45 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -110.11 166.21 12.43 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.482 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -97.91 136.43 38.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.797 0.332 . . . . 0.0 110.898 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -83.74 110.78 3.35 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.466 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -78.12 -71.5 0.42 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.896 0.379 . . . . 0.0 110.968 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 59.8 p -115.89 174.89 5.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.947 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -112.23 -60.26 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.793 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 62.42 84.48 0.19 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.031 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 39.4 Cg_exo -60.61 -16.3 42.11 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.668 2.245 . . . . 0.0 112.498 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.542 ' HB3' ' O ' ' A' ' 71' ' ' PRO . . . 75.56 91.06 0.08 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.076 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -142.29 -148.26 4.96 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.496 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.62 145.44 0.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 59.25 -177.59 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.912 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 0.0 OUTLIER 74.09 -60.84 0.51 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.086 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 76' ' ' GLU . 1.5 pm0 39.69 65.46 0.71 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.781 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.6 mtpp 61.95 -178.38 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.001 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 63.16 98.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.939 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 mp -98.14 -63.81 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 -149.35 102.15 3.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.848 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 61.19 76.89 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.054 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -141.23 105.17 6.06 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -68.45 111.12 2.44 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.342 2.028 . . . . 0.0 112.272 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.76 117.33 4.8 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.368 2.045 . . . . 0.0 112.289 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.2 m -73.12 -30.5 63.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.978 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.2 p -96.15 153.74 17.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -176.67 -40.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.945 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 118' ' ' ILE . 4.2 mm? -82.04 -40.68 21.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.941 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -48.74 -35.87 15.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.698 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 m -62.23 -12.59 21.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.552 ' HB3' HD23 ' A' ' 97' ' ' LEU . 8.0 m-85 -80.73 -8.04 59.54 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 122.256 -0.278 . . . . 0.0 111.346 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.87 -162.17 0.19 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.779 0.323 . . . . 0.0 111.079 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.597 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.9 t -115.78 -42.72 3.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.21 0.529 . . . . 0.0 110.947 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -78.21 -19.71 53.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.121 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.93 -27.53 54.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.936 0.398 . . . . 0.0 110.675 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.757 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -76.35 -59.08 2.92 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.506 ' CE ' HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -47.38 -34.93 7.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.741 177.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.94 -21.71 29.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.021 0.439 . . . . 0.0 111.737 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.438 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 4.1 mm-40 -86.65 -38.59 16.91 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.566 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.611 HD23 ' CZ ' ' A' ' 121' ' ' PHE . 3.2 mt -59.84 -48.07 83.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.118 0.485 . . . . 0.0 109.964 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.568 HG23 ' CE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -65.44 -39.03 91.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -6.57 58.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.3 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.494 ' HD3' HD11 ' A' ' 106' ' ' ILE . 2.1 ttt85 -100.12 -15.57 18.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.308 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 98.72 38.9 3.77 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.339 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.494 HD11 ' HD3' ' A' ' 104' ' ' ARG . 4.2 mp -110.32 -22.01 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.793 0.296 . . . . 0.0 111.045 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 106' ' ' ILE . 14.7 t 45.51 28.34 0.49 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.794 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.568 ' CE1' HG23 ' A' ' 102' ' ' THR . 90.2 m-85 51.24 -160.23 0.09 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.108 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 39.8 pttt 45.52 93.13 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.064 0.459 . . . . 0.0 111.322 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 179.0 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.618 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 179.18 42.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.765 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.713 ' HB1' ' HB2' ' A' ' 117' ' ' LEU . . . -145.22 147.67 32.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.201 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.419 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 52.5 p -139.72 -80.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.4 tttm -145.38 -57.12 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.74 0.305 . . . . 0.0 110.74 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.0 -22.18 33.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.088 0.471 . . . . 0.0 109.884 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -86.2 -38.22 17.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.677 179.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.713 ' HB2' ' HB1' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -74.5 -36.82 63.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.181 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.849 HD13 ' O ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -62.67 -28.54 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.402 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.27 -33.0 19.41 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.918 0.39 . . . . 0.0 111.559 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.3 OUTLIER -59.43 -53.02 62.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.305 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.611 ' CZ ' HD23 ' A' ' 101' ' ' LEU . 24.8 m-85 -43.55 90.55 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.939 0.399 . . . . 0.0 111.75 -178.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -174.98 115.25 0.29 Allowed Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.149 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.24 61.13 2.57 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.414 2.076 . . . . 0.0 112.254 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -179.62 175.9 0.84 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.964 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -177.62 173.87 1.59 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.893 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -142.9 -171.37 13.37 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -89.35 -26.76 20.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.739 0.304 . . . . 0.0 111.043 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.31 169.76 0.57 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.002 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.34 -65.37 1.02 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.891 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.89 163.02 28.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.87 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.102 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -86.52 125.61 33.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.812 0.339 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -99.14 -26.58 14.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.977 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 mmm 65.06 114.33 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.854 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.75 90.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -136.38 29.79 2.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.757 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 8.0 t -104.31 130.02 52.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.586 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -146.92 148.06 31.4 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.9 m -96.18 115.01 26.76 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.839 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -110.17 151.39 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-O 120.895 0.378 . . . . 0.0 111.59 -178.711 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.743 HG23 ' C ' ' A' ' 32' ' ' ASN . 7.6 p -137.4 131.7 44.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.538 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.849 HG13 HD13 ' A' ' 45' ' ' LEU . 29.3 m -93.06 104.75 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.287 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.402 ' HA ' ' HB3' ' A' ' 31' ' ' ASP . 0.6 OUTLIER -86.53 106.68 17.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.705 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.649 ' CG ' HD12 ' A' ' 51' ' ' LEU . 6.8 t30 -108.16 112.73 25.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.38 43.42 1.12 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.165 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.892 HG22 ' HG2' ' A' ' 17' ' ' LYS . 3.2 mp -106.38 -61.5 2.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.385 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.892 ' HG2' HG22 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -176.51 -170.73 0.36 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.765 0.317 . . . . 0.0 111.094 -179.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.417 ' HA ' ' N ' ' A' ' 29' ' ' LEU . 5.4 mm-40 -84.24 -7.78 59.24 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.655 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -136.18 80.38 0.3 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.81 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.522 ' CD1' HG21 ' A' ' 16' ' ' ILE . 3.4 t80 -130.48 23.94 5.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.82 0.343 . . . . 0.0 111.053 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 60.24 171.63 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.159 0.504 . . . . 0.0 111.492 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.48 ' CB ' ' HB2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -179.05 -84.62 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.29 178.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -101.69 15.88 27.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.936 0.398 . . . . 0.0 110.092 178.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.78 37.61 7.29 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.978 -0.629 . . . . 0.0 111.868 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -155.65 36.07 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 45.78 95.93 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.795 0.331 . . . . 0.0 111.464 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.48 ' HB2' ' CB ' ' A' ' 22' ' ' ARG . 10.9 t80 -77.42 138.98 39.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.049 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -70.09 176.51 3.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.769 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.573 HD13 ' C ' ' A' ' 29' ' ' LEU . 3.5 tm? -82.33 103.0 11.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.11 0.481 . . . . 0.0 110.644 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.27 -142.38 7.91 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.705 -0.679 . . . . 0.0 112.288 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.53 ' HB2' HG22 ' A' ' 11' ' ' VAL . 34.1 p-10 -138.44 139.16 38.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.963 0.411 . . . . 0.0 111.173 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.743 ' C ' HG23 ' A' ' 11' ' ' VAL . 2.0 t-20 -113.88 125.08 53.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.061 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.0 145.43 26.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.434 0.635 . . . . 0.0 111.685 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.939 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -112.09 138.95 48.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.816 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.939 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.45 156.68 39.04 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.279 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.757 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.46 108.4 4.26 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 111.426 -178.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.679 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -128.21 -176.51 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.186 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.679 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -48.82 -68.44 0.18 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.472 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.16 -17.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.5 t -42.42 -37.66 1.65 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.793 0.33 . . . . 0.0 111.687 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.686 ' HG2' HD11 ' A' ' 34' ' ' LEU . 2.3 pp0? -53.62 -50.46 65.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.456 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.683 HD13 ' CG2' ' A' ' 55' ' ' ILE . 5.7 tp -58.32 -46.47 86.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.091 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.87 -33.09 68.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.301 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -44.31 93.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.943 0.402 . . . . 0.0 110.279 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.849 HD13 HG13 ' A' ' 12' ' ' VAL . 21.9 mt -78.74 -33.63 46.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.885 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.4 mttt -71.17 -22.58 62.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.132 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.09 -61.83 1.7 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.574 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.03 124.51 53.94 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.69 56.89 6.24 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.576 2.184 . . . . 0.0 112.418 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.563 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -111.69 -39.36 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.944 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.688 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -111.86 -173.1 2.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.446 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.668 ' O ' HG23 ' A' ' 52' ' ' VAL . 16.2 m -119.44 106.26 18.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.835 0.35 . . . . 0.0 111.881 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.469 HG23 HD12 ' A' ' 45' ' ' LEU . 2.5 p -99.87 106.19 18.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.172 0.51 . . . . 0.0 110.757 179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.455 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -127.33 127.89 45.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.107 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.839 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.13 130.35 37.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.05 0.452 . . . . 0.0 111.455 -179.824 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.9 p -122.32 104.64 9.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.559 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -105.12 -60.48 1.61 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.018 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 t -129.17 -46.06 1.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.918 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 172.54 168.4 33.86 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.456 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.9 p -103.98 142.75 33.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.813 0.34 . . . . 0.0 110.982 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.84 175.68 9.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.914 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 60.36 29.76 19.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.875 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -93.63 -23.4 23.73 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.574 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 179.51 -35.85 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.531 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -91.02 50.41 1.78 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.849 0.357 . . . . 0.0 110.925 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.445 ' H ' HD23 ' A' ' 67' ' ' LEU . . . -164.83 84.42 0.1 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.511 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.445 HD23 ' H ' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -168.23 -177.38 3.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.825 0.345 . . . . 0.0 110.933 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.0 m -146.43 -48.11 0.2 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.895 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -101.24 129.86 47.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.867 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -154.7 157.1 32.04 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.883 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.56 -168.14 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.582 2.188 . . . . 0.0 112.309 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.07 80.64 3.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.073 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -103.98 108.23 3.14 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.548 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.26 126.63 24.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.925 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 60.22 32.03 20.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.89 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.86 85.67 2.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.799 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.75 8.61 30.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.311 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 mttt 61.91 -81.07 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.745 0.307 . . . . 0.0 111.002 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.38 138.95 50.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.863 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.54 -48.5 1.93 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -158.66 146.27 17.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.851 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -101.3 126.66 48.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.1 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.457 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 0.3 OUTLIER -168.22 -65.01 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.939 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 2.5 Cg_endo -42.63 -57.71 1.56 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.806 2.338 . . . . 0.0 112.628 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.436 ' HD3' ' HG2' ' A' ' 84' ' ' PRO . 55.7 Cg_endo -69.62 143.93 53.1 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.376 2.051 . . . . 0.0 112.316 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -171.34 -67.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.919 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.9 p -71.89 -178.04 2.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 67.42 -69.98 0.13 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.035 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.5 HD11 ' O ' ' A' ' 118' ' ' ILE . 1.7 mm? -64.18 -15.92 60.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.386 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -48.62 -49.44 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.7 0.286 . . . . 0.0 111.221 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -10.1 10.3 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 3.7 m-85 -104.9 127.45 52.73 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.691 0.281 . . . . 0.0 110.655 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.499 ' O ' HG21 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -116.3 -87.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.06 -179.729 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.789 ' HA ' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -151.83 -37.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-O 120.972 0.415 . . . . 0.0 111.047 179.855 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.63 -19.66 35.05 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.869 0.366 . . . . 0.0 110.99 178.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -77.91 -43.1 31.03 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.246 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.966 HD23 HD21 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -64.8 -55.84 17.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.868 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.465 ' CD ' ' O ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -50.89 -31.95 19.08 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.0 178.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.06 -25.26 27.71 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.122 0.487 . . . . 0.0 111.537 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 1.7 mt-30 -86.88 -43.59 12.33 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.888 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.776 HD22 HG21 ' A' ' 106' ' ' ILE . 8.8 mt -54.74 -46.75 74.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.465 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -39.07 88.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.855 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -15.85 63.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.293 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.652 ' HD3' HD23 ' A' ' 101' ' ' LEU . 8.7 ptm180 -107.96 -15.23 14.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.047 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.59 83.9 0.47 Allowed Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.826 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.776 HG21 HD22 ' A' ' 101' ' ' LEU . 14.6 tt -125.84 -39.46 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.69 0.281 . . . . 0.0 111.524 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.1 m 71.58 87.8 0.11 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.647 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -116.0 124.89 51.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.997 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -176.98 37.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -170.8 30.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.341 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 84.2 p 178.78 -76.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.749 0.309 . . . . 0.0 110.922 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 117' ' ' LEU . . . -64.08 81.02 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.734 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -72.4 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.364 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.776 ' O ' HG23 ' A' ' 118' ' ' ILE . 0.3 OUTLIER -146.05 -57.44 0.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.491 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.28 67.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 11.8 mm-40 -85.91 -37.1 19.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.886 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.966 HD21 HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -69.15 -40.85 77.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.828 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.776 HG23 ' O ' ' A' ' 114' ' ' LYS . 0.9 OUTLIER -70.6 -30.5 42.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.599 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.476 ' N ' HG13 ' A' ' 118' ' ' ILE . . . -86.16 -31.83 21.6 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.34 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 1.1 mp -54.52 -42.75 71.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.323 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.511 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 1.9 m-85 -46.04 -28.09 1.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.601 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.48 ' HB2' HD21 ' A' ' 89' ' ' LEU . . . -47.34 131.37 9.98 Favored Pre-proline 0 CA--C 1.531 0.238 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.23 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -51.57 -41.77 59.19 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.448 2.099 . . . . 0.0 112.391 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -161.05 147.23 14.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -129.25 35.01 4.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -157.15 -44.12 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.513 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -135.47 126.45 27.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.844 0.354 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -176.33 151.14 0.97 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.873 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 60.29 -178.44 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.926 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -135.59 -47.25 0.68 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.922 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.148 -0.929 . . . . 0.0 111.146 179.905 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 t -91.57 163.24 14.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.819 0.342 . . . . 0.0 110.994 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 61.3 114.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.2 mtt -155.33 160.33 40.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -60.7 93.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.867 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -113.05 -29.79 7.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.038 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.776 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 12.5 t -138.57 130.7 28.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.962 0.41 . . . . 0.0 111.072 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -146.79 145.28 29.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.24 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.6 p -94.45 133.4 38.08 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.762 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.43 155.86 11.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 121.039 0.447 . . . . 0.0 111.569 -179.093 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.3 p -138.34 101.53 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.596 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.719 HG21 HD22 ' A' ' 45' ' ' LEU . 36.2 t -92.69 129.23 43.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.161 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.81 107.41 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.433 ' HB3' ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -128.22 144.22 51.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.909 0.385 . . . . 0.0 110.753 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -120.57 81.58 1.78 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.198 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.3 mt -129.65 -58.01 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.171 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.23 -18.07 0.91 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.715 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 65.63 23.13 11.67 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.138 0.494 . . . . 0.0 110.318 -179.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -178.07 57.61 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.497 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.531 ' HB2' HD11 ' A' ' 29' ' ' LEU . 1.1 t80 -91.09 30.97 1.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.892 0.377 . . . . 0.0 111.352 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.02 -173.29 0.12 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.186 0.517 . . . . 0.0 111.817 178.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.5 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 14.9 tpp180 -178.61 -33.73 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.927 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 22' ' ' ARG . . . 170.69 -32.18 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.653 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 155.59 31.37 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.082 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -129.56 20.19 5.65 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.522 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.401 ' O ' ' CD2' ' A' ' 28' ' ' HIS . 0.4 OUTLIER 42.96 37.56 1.15 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.956 0.408 . . . . 0.0 110.93 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.446 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -45.26 96.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.643 -179.336 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.401 ' CD2' ' O ' ' A' ' 26' ' ' SER . 14.2 m170 -60.94 124.5 20.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.537 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 20' ' ' TYR . 17.3 mt -58.2 -32.41 68.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.116 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -55.64 -168.56 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.756 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -57.33 121.07 9.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 111.411 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 23.0 t-20 -143.64 123.66 13.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.4 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -86.85 145.58 26.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.398 0.618 . . . . 0.0 111.361 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.939 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -115.37 141.37 48.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.97 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.939 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.32 156.1 39.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.158 0.504 . . . . 0.0 110.555 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.776 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.56 105.34 3.07 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.496 0.665 . . . . 0.0 111.715 -177.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.647 HG23 ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -122.31 -175.92 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.909 -179.674 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.647 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -59.73 -63.91 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.558 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -173.43 -18.64 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.7 m -42.41 -32.1 0.49 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.991 0.424 . . . . 0.0 111.011 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.649 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.59 -61.64 2.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.548 179.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.467 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 7.3 tp -52.6 -52.83 53.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.71 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.591 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -66.42 -34.88 78.95 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.682 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.09 -52.52 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.909 0.385 . . . . 0.0 110.438 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.719 HD22 HG21 ' A' ' 12' ' ' VAL . 0.5 OUTLIER -78.71 -54.54 6.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.748 179.516 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.532 ' N ' HG11 ' A' ' 53' ' ' VAL . 1.3 tptt -53.47 -24.05 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.304 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.26 -29.94 1.82 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 111.372 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -128.62 125.78 23.2 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 61.28 4.96 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.405 2.07 . . . . 0.0 112.366 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.805 ' C ' HD13 ' A' ' 51' ' ' LEU . 20.8 mmt-85 -123.91 -39.69 2.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.805 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.0 OUTLIER -119.85 133.44 55.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.962 0.41 . . . . 0.0 110.971 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.458 ' O ' HG13 ' A' ' 12' ' ' VAL . 4.2 t -68.87 107.21 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.768 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.532 HG11 ' N ' ' A' ' 46' ' ' LYS . 2.1 p -103.4 115.26 45.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.938 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.754 ' O ' HG22 ' A' ' 10' ' ' VAL . 31.0 mt-30 -127.07 144.9 50.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.833 -0.622 . . . . 0.0 112.165 -178.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.748 HG22 HG23 ' A' ' 10' ' ' VAL . 1.9 pt -102.64 134.39 43.68 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.176 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.8 m -122.4 104.64 9.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -69.81 -70.57 0.28 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 67.8 p -144.42 -176.62 5.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.963 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -129.33 100.17 0.49 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.547 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.61 -27.03 58.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.784 0.326 . . . . 0.0 111.031 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -56.28 133.1 52.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.011 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 60.92 156.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -94.51 -37.58 5.27 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.503 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.87 152.22 6.36 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.539 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -174.77 39.08 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.833 0.349 . . . . 0.0 110.938 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -145.95 172.74 26.52 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.482 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.24 -41.07 6.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.749 0.309 . . . . 0.0 110.911 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 52.3 p 53.97 65.53 1.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.111 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -163.78 31.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.941 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.506 ' N ' ' HD2' ' A' ' 71' ' ' PRO . 5.0 tp10 -72.66 -50.09 7.86 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.225 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 70' ' ' GLU . 73.5 Cg_endo -74.98 136.61 20.67 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.283 1.989 . . . . 0.0 112.383 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.44 81.06 1.56 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.055 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 68.03 72.94 0.74 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.558 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.54 -59.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.808 0.337 . . . . 0.0 110.941 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.72 -42.37 67.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.912 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -70.34 -169.76 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.947 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 64.54 135.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.917 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -64.71 93.67 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.982 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -172.75 117.5 0.33 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.488 HD23 ' NH2' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -139.27 139.69 37.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.845 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.488 ' NH2' HD23 ' A' ' 80' ' ' LEU . 0.1 OUTLIER 59.59 -179.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.966 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -144.17 159.63 42.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.995 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -166.39 63.05 0.77 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.814 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.455 ' HG2' ' HD3' ' A' ' 85' ' ' PRO . 4.1 Cg_exo -39.17 -51.92 2.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.251 2.634 . . . . 0.0 112.751 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.455 ' HD3' ' HG2' ' A' ' 84' ' ' PRO . 87.9 Cg_exo -46.06 98.9 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.419 2.08 . . . . 0.0 112.425 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.4 m -59.24 -30.64 68.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.857 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.451 HG22 ' H ' ' A' ' 88' ' ' ASP . 0.2 OUTLIER -151.05 -170.49 3.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.811 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.525 ' C ' HD22 ' A' ' 89' ' ' LEU . 0.9 OUTLIER -110.66 -30.57 7.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.811 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.561 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.0 mm? -117.24 -43.74 2.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.885 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.422 ' HB2' ' CB ' ' A' ' 87' ' ' THR . 1.9 m120 -48.97 -37.18 19.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.495 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 38.3 p -61.98 -15.21 42.1 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -94.23 133.8 37.37 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.804 0.335 . . . . 0.0 110.675 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.671 ' O ' HG13 ' A' ' 94' ' ' VAL . 3.0 p -74.45 -94.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.359 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.671 HG13 ' O ' ' A' ' 93' ' ' THR . 1.4 m -164.41 -38.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.054 0.454 . . . . 0.0 110.79 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -81.75 -20.88 38.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.691 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -66.95 -52.23 45.45 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.349 0.595 . . . . 0.0 109.74 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 1.044 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.92 -59.61 4.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.715 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.45 ' HE3' HD12 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -44.65 -38.35 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.939 178.431 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.19 -21.92 28.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.048 0.452 . . . . 0.0 111.669 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 6.8 mm-40 -86.37 -47.81 9.02 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.09 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.667 HD13 HG21 ' A' ' 106' ' ' ILE . 5.5 mt -51.89 -48.3 64.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.164 0.506 . . . . 0.0 109.845 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.497 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -62.12 -41.42 98.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.229 179.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.74 -6.96 50.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.106 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -105.81 -15.43 14.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 78.5 70.94 1.27 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.94 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.718 HG23 ' N ' ' A' ' 107' ' ' THR . 0.2 OUTLIER -128.26 -159.33 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.718 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -140.45 116.11 10.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.838 0.351 . . . . 0.0 110.791 179.88 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.497 ' CZ ' HG23 ' A' ' 102' ' ' THR . 2.4 p90 -138.72 105.85 5.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.987 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -176.78 37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.783 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.52 -50.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 91.6 p -101.05 -63.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.465 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -70.61 64.79 0.3 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.07 0.462 . . . . 0.0 110.334 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 1.7 m -61.19 -75.14 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.346 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.976 ' O ' HG23 ' A' ' 118' ' ' ILE . 1.5 ptmt -146.3 -57.46 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.718 0.294 . . . . 0.0 111.434 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.24 -23.01 64.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.863 0.363 . . . . 0.0 111.115 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.4 mm-40 -85.82 -36.29 20.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.855 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.765 ' HG ' HD13 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -74.48 -37.11 63.28 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.597 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 1.044 ' HA ' HD22 ' A' ' 97' ' ' LEU . 1.7 pp -64.72 -35.19 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.579 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.33 -28.26 23.79 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.891 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.789 HD22 ' O ' ' A' ' 120' ' ' LEU . 1.0 OUTLIER -65.01 -30.6 71.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.687 -179.086 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.507 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.0 OUTLIER -61.37 82.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.721 0.296 . . . . 0.0 111.151 -179.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -125.23 74.91 68.06 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.303 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.98 124.66 12.97 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.682 2.254 . . . . 0.0 112.106 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -153.5 117.85 4.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.167 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.85 109.4 18.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.857 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -59.28 -92.57 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.653 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -150.89 -46.38 0.12 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.765 0.316 . . . . 0.0 111.06 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -123.73 79.96 1.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.818 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 63.6 p -81.96 160.26 23.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.935 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -102.81 165.22 11.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.875 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.092 179.995 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m 60.59 80.63 0.21 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.808 0.337 . . . . 0.0 110.938 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -87.36 -59.72 2.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.893 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.1 mtt -147.04 99.95 3.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.791 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -135.34 -49.61 0.73 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -150.06 158.17 43.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.017 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.844 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -116.68 139.83 50.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.793 -179.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.488 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.22 144.09 30.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.43 0.633 . . . . 0.0 112.393 -179.522 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.4 p -95.1 121.83 37.14 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.801 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.81 151.53 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 111.355 -178.775 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.9 p -134.17 123.5 43.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.242 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.119 HG13 HD23 ' A' ' 45' ' ' LEU . 1.8 m -95.65 104.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.784 -179.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.43 106.89 19.19 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.896 178.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.446 ' O ' HD12 ' A' ' 29' ' ' LEU . 12.3 p-10 -96.3 117.09 30.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.24 0.543 . . . . 0.0 111.61 -179.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.5 28.59 4.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.184 178.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.719 HD13 ' CD2' ' A' ' 20' ' ' TYR . 7.3 mt -83.78 -77.77 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.268 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.547 ' N ' HG22 ' A' ' 16' ' ' ILE . 11.2 mtmt -155.26 -168.6 2.9 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.733 0.301 . . . . 0.0 110.844 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -102.41 28.03 6.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.556 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 176.96 58.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.288 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.719 ' CD2' HD13 ' A' ' 16' ' ' ILE . 9.4 t80 -99.66 19.52 15.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 0.0 110.921 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 62.14 174.57 0.13 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.316 0.579 . . . . 0.0 111.819 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.527 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -171.83 -79.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.862 179.001 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.96 -4.72 52.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.563 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.91 44.66 0.8 Allowed Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.972 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.492 ' O ' ' CB ' ' A' ' 26' ' ' SER . 0.8 OUTLIER -156.52 -56.03 0.09 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.454 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.492 ' CB ' ' O ' ' A' ' 25' ' ' PHE . 2.5 p 154.2 116.5 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.63 0.372 . . . . 0.0 110.179 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.527 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 38.0 t80 -87.79 -18.68 28.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.387 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 65.37 170.23 0.21 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.765 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 14' ' ' ASN . 14.1 tp -90.65 105.75 18.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.561 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 177.06 -141.4 5.35 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.357 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.484 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 2.2 p30 -150.06 136.36 18.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.679 0.276 . . . . 0.0 111.201 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 40.2 t30 -116.74 131.94 56.82 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.291 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.02 145.54 26.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.536 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.961 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -113.75 140.61 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.19 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.961 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.29 157.5 37.59 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.202 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.844 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.4 112.74 6.14 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.734 0.778 . . . . 0.0 111.2 -177.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.547 ' N ' HG22 ' A' ' 7' ' ' THR . 3.5 t -128.35 168.82 20.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 CA-C-N 114.463 -1.244 . . . . 0.0 110.584 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.54 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.2 m -55.3 -61.25 2.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.273 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -164.91 -16.76 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.488 ' OG ' HG11 ' A' ' 37' ' ' VAL . 3.0 p -43.62 -33.67 1.25 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.501 ' CD ' ' N ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -65.79 -37.43 86.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.799 0.333 . . . . 0.0 111.749 -179.61 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.501 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 5.2 tp -68.31 -38.75 81.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -86.86 -28.99 22.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.276 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -47.93 81.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.874 0.369 . . . . 0.0 110.378 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 1.119 HD23 HG13 ' A' ' 12' ' ' VAL . 1.9 mp -79.02 -41.53 28.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.46 ' N ' HG11 ' A' ' 53' ' ' VAL . 3.5 ttpt -73.27 -12.74 60.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.299 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.565 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -50.81 -33.29 22.92 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.822 0.344 . . . . 0.0 111.295 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 p-10 -121.66 129.83 25.03 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.83 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -77.09 70.82 6.52 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.5 2.134 . . . . 0.0 112.272 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.431 ' C ' HD12 ' A' ' 51' ' ' LEU . 2.0 mtt85 -131.8 -56.01 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.886 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.555 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.8 mp -100.51 170.46 8.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.628 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.9 t -105.58 107.39 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.608 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.509 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 1.5 p -101.18 114.57 40.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.29 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.476 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.8 OUTLIER -127.12 125.93 42.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.454 -179.232 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.801 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.19 145.79 7.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.289 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 44.3 p -121.99 104.61 9.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.644 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -59.56 -76.73 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.016 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 p -108.53 111.01 22.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.977 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -115.17 27.49 8.52 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.472 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 t -108.88 -32.35 7.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.828 0.347 . . . . 0.0 110.892 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.91 97.94 2.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.88 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 61.43 92.37 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.783 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -97.3 -160.15 31.28 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.579 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -130.3 -173.92 13.53 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.454 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -105.42 -31.32 9.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.855 0.359 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 114.28 137.27 6.48 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.59 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.5 mt -148.08 40.81 0.98 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.862 0.363 . . . . 0.0 110.856 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.41 139.63 31.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.946 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -114.35 128.64 56.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.912 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.402 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 0.4 OUTLIER -87.88 -53.8 0.37 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.889 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 60.3 Cg_exo -51.43 -40.37 62.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.532 2.155 . . . . 0.0 112.237 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.71 150.21 32.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.024 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 164.63 -83.3 0.11 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.502 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 p -174.46 128.59 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.94 0.4 . . . . 0.0 110.842 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -152.18 133.82 14.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 63.32 -81.33 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.953 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.01 -174.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.028 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.0 tttt -80.35 117.88 21.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.933 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -157.13 131.96 8.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.3 mp -105.57 150.01 25.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.854 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.7 tpt85 -160.74 -69.14 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.988 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.38 113.24 3.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.076 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.413 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 2.5 m-20 -79.98 -61.61 0.44 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.066 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.413 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 73.2 Cg_endo -76.03 123.31 7.22 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.503 2.135 . . . . 0.0 112.327 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.35 -62.24 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.396 2.064 . . . . 0.0 112.234 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.1 m -133.67 102.58 5.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.784 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.8 p -138.24 60.5 1.62 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 59.8 163.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 118' ' ' ILE . 12.5 tp 75.47 -56.36 0.61 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.217 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.8 m-20 -48.78 -45.63 40.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.428 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.3 p -62.09 -14.55 37.63 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -84.09 143.82 29.46 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.684 0.278 . . . . 0.0 110.594 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 69.9 p -110.63 -88.23 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.588 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.617 HG13 ' HG3' ' A' ' 114' ' ' LYS . 40.6 t -154.56 -43.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -80.3 -20.84 43.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.081 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.466 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -71.1 -49.58 42.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 0.0 110.19 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.776 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -56.02 -58.56 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.528 179.557 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.476 ' HE2' HD11 ' A' ' 117' ' ' LEU . 4.1 ttmt -55.63 -34.67 65.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.02 -21.64 29.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.056 0.455 . . . . 0.0 111.573 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.466 ' N ' ' O ' ' A' ' 96' ' ' GLN . 3.5 mm-40 -86.53 -41.09 14.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.302 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.69 HD22 HG21 ' A' ' 106' ' ' ILE . 12.9 mt -56.14 -49.91 72.61 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.315 0.579 . . . . 0.0 109.754 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.69 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -64.11 -38.96 92.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.324 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.65 -6.84 53.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.957 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.3 mtt180 -100.36 -15.32 18.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.858 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.96 47.58 4.97 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.838 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.69 HG21 HD22 ' A' ' 101' ' ' LEU . 9.2 tt -140.43 95.91 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.822 0.344 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.03 122.94 9.33 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.951 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.69 ' HE1' HG23 ' A' ' 102' ' ' THR . 13.7 p90 -121.56 28.02 7.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.131 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -29.34 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.852 0.358 . . . . 0.0 110.77 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -124.98 150.97 46.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.855 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.15 26.34 13.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 108' ' ' PHE . . . -148.53 103.99 3.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.18 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.4 ' OG1' ' N ' ' A' ' 114' ' ' LYS . 72.3 p -98.92 -79.38 0.48 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.725 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.668 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 20.4 tttt -158.4 -39.5 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.087 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.7 -20.44 33.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.028 0.442 . . . . 0.0 110.224 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -85.59 -39.08 17.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.756 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.668 ' CD2' ' HA ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -78.31 -19.55 53.31 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.153 -179.771 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.776 ' HA ' HD22 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -80.79 -28.39 11.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 120.566 -0.453 . . . . 0.0 109.974 178.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.428 ' HA ' HD11 ' A' ' 89' ' ' LEU . . . -87.09 -33.12 19.59 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.133 0.492 . . . . 0.0 111.106 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.5 OUTLIER -54.18 -42.76 70.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.269 -178.911 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.578 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 30.7 m-85 -59.27 83.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.917 0.389 . . . . 0.0 111.305 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -164.15 87.71 1.14 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.126 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -50.07 -46.55 27.7 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.591 2.194 . . . . 0.0 112.381 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 58.31 105.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.183 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.65 30.31 3.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.92 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 94.27 75.58 1.29 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.522 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -132.5 -178.11 4.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.798 0.332 . . . . 0.0 110.916 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt -60.33 145.68 46.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.888 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.12 155.49 22.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.813 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -121.0 40.54 3.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.965 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.081 179.987 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.105 0 N-CA-C 112.546 -0.222 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -157.83 33.75 0.26 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.757 0.313 . . . . 0.0 110.853 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.7 p-80 -107.63 -43.69 4.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.851 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 17.4 mtt -132.89 156.86 46.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.968 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -101.07 128.21 47.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.942 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.56 59.72 1.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.712 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.867 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -129.47 140.08 51.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.821 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.501 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.17 143.81 30.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.434 0.635 . . . . 0.0 112.632 -179.659 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 24.4 p -95.55 121.4 37.2 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.772 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.73 150.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.003 0.43 . . . . 0.0 111.282 -178.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.4 p -134.06 120.58 35.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.259 0.552 . . . . 0.0 111.522 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.723 HG11 HD22 ' A' ' 45' ' ' LEU . 11.5 m -94.17 104.53 15.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.382 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -98.63 105.28 17.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.981 0.419 . . . . 0.0 110.15 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.642 HD21 HG13 ' A' ' 52' ' ' VAL . 13.1 m120 -137.98 146.9 43.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.065 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -145.94 74.43 1.38 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.77 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.494 ' HB ' HD22 ' A' ' 29' ' ' LEU . 21.2 mt -101.22 -50.59 10.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.235 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -143.35 -99.36 0.12 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.013 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 168.43 43.51 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.183 0.516 . . . . 0.0 110.111 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.705 ' H ' HD12 ' A' ' 29' ' ' LEU . . . 149.28 66.05 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.404 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.664 ' CB ' HD11 ' A' ' 29' ' ' LEU . 15.9 t80 -111.82 59.23 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.003 0.43 . . . . 0.0 111.221 -179.013 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.472 ' HD3' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 33.68 83.83 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.439 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.661 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -85.34 54.27 3.05 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.647 179.38 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . 93.13 -24.1 0.05 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.462 0.305 . . . . 0.0 111.161 -179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 152.22 -23.5 0.87 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.125 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -82.44 -2.14 52.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.691 0.281 . . . . 0.0 110.796 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 46.09 78.62 0.06 Allowed 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.43 0.633 . . . . 0.0 110.84 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.523 ' HB2' ' CB ' ' A' ' 22' ' ' ARG . 8.2 t80 -68.81 150.23 48.07 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.725 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -82.17 15.8 2.23 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.705 HD12 ' H ' ' A' ' 19' ' ' GLY . 0.7 OUTLIER 47.89 79.42 0.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.283 0.563 . . . . 0.0 111.27 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.436 ' HA2' ' O ' ' A' ' 14' ' ' ASN . . . -152.36 -135.18 2.18 Favored Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.473 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.404 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -120.63 116.14 24.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.758 0.314 . . . . 0.0 110.735 179.365 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 17.9 t30 -129.94 131.04 45.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.943 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.14 145.48 26.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.302 0.572 . . . . 0.0 111.121 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.966 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -111.72 140.46 46.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.26 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.966 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.26 157.63 37.35 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.11 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.867 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.6 112.13 5.88 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.685 0.755 . . . . 0.0 111.287 -177.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.553 ' N ' HG22 ' A' ' 7' ' ' THR . 4.1 t -127.77 168.26 21.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.088 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.656 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.524 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.7 t -55.09 -58.85 5.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.397 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -167.91 -17.07 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.5 m -43.43 -33.25 1.03 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.551 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -66.52 -41.45 88.78 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.829 0.347 . . . . 0.0 111.837 -179.551 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.478 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 4.8 tp -66.77 -34.36 77.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.501 -178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -91.94 -30.71 15.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.632 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.31 -42.42 88.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.947 0.403 . . . . 0.0 110.41 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.723 HD22 HG11 ' A' ' 12' ' ' VAL . 63.0 mt -79.04 -47.22 16.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.925 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.414 ' N ' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -60.44 -17.82 47.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.438 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.13 -39.87 6.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.801 0.334 . . . . 0.0 111.65 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.1 121.56 58.68 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.826 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -84.17 49.42 2.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.677 2.252 . . . . 0.0 112.774 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.23 -38.1 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.272 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.739 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -93.55 -165.59 1.36 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.426 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.672 ' O ' HG12 ' A' ' 12' ' ' VAL . 2.3 m -132.56 133.0 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.414 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.6 p -131.83 112.83 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.021 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.514 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.4 OUTLIER -127.66 126.21 41.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.837 -178.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.772 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.4 pp -88.11 126.66 41.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.042 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.1 p -122.21 104.55 9.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.62 -62.22 1.28 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.908 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.2 t -117.57 105.99 12.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.867 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.82 120.12 10.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.669 -0.776 . . . . 0.0 112.475 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -169.91 69.27 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.876 0.369 . . . . 0.0 110.859 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -164.2 89.24 0.54 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -98.55 30.66 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.901 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -135.12 154.18 21.48 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.49 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -172.91 127.12 1.33 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.52 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.78 -31.1 15.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.869 0.366 . . . . 0.0 110.851 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 137.02 -131.85 5.76 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.551 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mp -130.43 -175.58 3.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.821 0.343 . . . . 0.0 110.851 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -170.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.946 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.9 mttt -59.97 171.26 0.99 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -151.08 148.64 23.12 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.828 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.62 62.57 2.95 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.548 2.165 . . . . 0.0 112.323 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.76 142.15 29.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.071 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -140.97 54.67 0.63 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.483 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 64.47 -78.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.77 0.319 . . . . 0.0 110.98 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -137.62 177.63 7.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.902 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 60.29 81.99 0.17 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.885 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -130.97 -48.05 1.02 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.946 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 mttt 60.81 157.04 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -179.2 -37.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.0 mt -53.87 128.17 29.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.052 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -122.13 30.36 6.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.98 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -128.18 154.95 45.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.978 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.56 106.25 0.64 Allowed Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.063 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -62.69 155.4 59.31 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.511 2.141 . . . . 0.0 112.214 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.07 61.33 3.94 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.506 2.137 . . . . 0.0 112.173 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.9 m -151.26 150.64 30.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.617 HG22 ' H ' ' A' ' 89' ' ' LEU . 65.1 m 58.96 -86.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 58.52 38.49 25.43 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.804 0.335 . . . . 0.0 110.915 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.617 ' H ' HG22 ' A' ' 87' ' ' THR . 3.1 mm? -111.82 -17.67 12.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.431 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -49.07 -50.12 38.27 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.726 0.298 . . . . 0.0 111.132 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -13.05 25.9 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -94.84 122.82 37.86 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.643 0.259 . . . . 0.0 110.6 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.555 ' O ' HD11 ' A' ' 97' ' ' LEU . 15.9 p -117.98 -95.49 0.48 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.349 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.954 ' HA ' HD21 ' A' ' 97' ' ' LEU . 3.4 m -138.2 -34.87 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.89 0.376 . . . . 0.0 111.438 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -82.78 -20.41 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.283 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -38.22 21.98 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.954 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -76.3 -49.21 17.56 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.024 -0.671 . . . . 0.0 109.717 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.691 ' HE2' HD11 ' A' ' 117' ' ' LEU . 0.9 OUTLIER -56.44 -33.75 66.16 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.696 178.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.18 -25.76 27.21 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 120.895 0.379 . . . . 0.0 111.973 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 3.5 mt-30 -86.68 -42.82 13.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.014 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.924 HD22 HG21 ' A' ' 106' ' ' ILE . 6.6 mt -54.48 -48.1 72.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.087 0.47 . . . . 0.0 110.385 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -39.64 92.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.062 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.64 -6.85 52.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.134 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -106.17 -15.22 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.047 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.89 68.4 1.56 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.774 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.924 HG21 HD22 ' A' ' 101' ' ' LEU . 0.4 OUTLIER -119.28 -146.74 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.641 ' N ' HG23 ' A' ' 106' ' ' ILE . 4.8 t -150.78 105.11 3.24 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 122.169 -0.332 . . . . 0.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.656 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.8 p90 -142.92 66.28 1.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.948 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.35 -31.14 7.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.48 62.11 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.045 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 179.35 -38.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.024 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.656 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -112.49 108.31 17.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.017 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.75 -74.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.308 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.792 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -144.83 -43.89 0.24 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -78.78 -24.31 44.75 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.929 0.395 . . . . 0.0 110.569 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.6 mm-40 -85.94 -36.5 19.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.563 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.834 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -80.04 -19.71 46.97 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.204 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.834 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.73 -27.01 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.99 -34.55 19.22 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.764 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.5 tp -51.57 -44.4 62.73 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.472 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.471 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 4.9 m-85 -54.75 -23.46 17.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.459 ' HA ' HD21 ' A' ' 89' ' ' LEU . . . -52.82 154.45 4.94 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.224 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.6 105.7 0.8 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.519 2.146 . . . . 0.0 112.293 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -160.66 90.69 0.87 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.045 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.69 91.15 4.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.97 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -112.36 -78.13 0.88 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.475 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -120.58 175.99 5.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.763 0.316 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.92 130.79 1.57 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.867 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 1.4 m -151.29 -178.18 6.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.87 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -72.2 -72.86 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.94 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.283 -0.865 . . . . 0.0 111.088 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 N-CA-C 112.429 -0.268 . . . . 0.0 112.429 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.31 -52.01 0.88 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.856 0.36 . . . . 0.0 110.91 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -99.49 31.44 3.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.93 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.95 138.98 48.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.825 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.6 167.86 14.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.943 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.4 mttp -121.4 85.73 2.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.939 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.749 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 5.6 t -134.45 129.86 35.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.761 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -147.08 152.25 38.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.098 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 2.6 m -92.4 124.96 36.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -110.12 151.18 12.41 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 111.659 -178.82 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -138.01 132.9 43.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.368 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.646 HG12 ' O ' ' A' ' 52' ' ' VAL . 28.0 m -101.97 104.71 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.795 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.438 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -101.34 106.59 17.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.006 179.01 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.407 ' ND2' ' HA ' ' A' ' 29' ' ' LEU . 2.1 p-10 -125.77 145.79 50.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.253 0.549 . . . . 0.0 111.671 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.428 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.0 OUTLIER -126.97 74.98 1.54 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.46 178.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.31 115.23 5.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.708 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.747 ' O ' HD13 ' A' ' 29' ' ' LEU . 6.3 ptpt 39.57 -162.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.935 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -138.32 10.05 2.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.015 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -97.14 -28.94 8.27 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.07 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.16 98.81 0.04 OUTLIER 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.377 0.608 . . . . 0.0 109.723 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.511 ' HA ' ' C ' ' A' ' 26' ' ' SER . 17.6 ptt180 -155.65 150.47 26.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.593 -177.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 26' ' ' SER . 0.0 OUTLIER 171.7 -169.46 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.011 0.434 . . . . 0.0 111.77 179.381 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.12 66.38 7.68 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.331 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.409 ' HA2' ' CZ ' ' A' ' 27' ' ' PHE . . . 95.53 -20.15 50.95 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.481 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -75.05 -24.91 58.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.65 0.262 . . . . 0.0 111.139 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.811 ' HA ' HD21 ' A' ' 51' ' ' LEU . 72.1 p -176.4 160.95 2.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.823 0.344 . . . . 0.0 111.236 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD1' ' O ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -157.03 153.18 27.54 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.23 179.194 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -41.91 142.86 0.62 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.145 0.498 . . . . 0.0 111.582 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -52.3 91.05 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.156 179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -156.7 -146.97 4.62 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.417 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.438 ' HB3' ' CG ' ' A' ' 13' ' ' GLN . 3.5 p-10 -141.25 128.14 20.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.038 0.447 . . . . 0.0 111.265 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.427 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 16.2 m-20 -126.71 127.53 45.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.956 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.7 m -86.96 145.32 26.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.422 0.63 . . . . 0.0 111.739 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.957 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -111.51 138.22 48.32 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.698 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.957 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.48 156.41 39.41 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.923 0.392 . . . . 0.0 110.192 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.749 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.72 109.96 5.24 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.431 0.634 . . . . 0.0 111.723 -177.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.649 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -128.78 -177.01 1.74 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.039 -179.654 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.649 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -51.13 -64.85 0.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.366 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -177.75 -16.59 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -42.25 -34.47 0.78 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.586 ' HG2' HD11 ' A' ' 34' ' ' LEU . 1.4 pp0? -57.25 -49.87 74.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 0.0 111.232 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -56.14 -53.66 54.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.088 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.19 -27.0 64.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.216 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -64.5 -51.85 60.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.86 0.362 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.536 ' HG ' ' CG1' ' A' ' 12' ' ' VAL . 3.2 mm? -78.51 -32.18 47.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.088 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.653 ' HB2' HG11 ' A' ' 53' ' ' VAL . 13.8 tttt -75.11 -29.6 60.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.156 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -56.12 -62.84 1.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.6 120.43 81.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.83 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.41 59.91 6.85 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.514 2.142 . . . . 0.0 112.41 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.521 ' C ' HD13 ' A' ' 51' ' ' LEU . 1.9 mpt_? -115.91 -64.54 1.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.982 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -106.99 -176.82 3.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.566 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 12' ' ' VAL . 3.1 m -103.55 146.37 11.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.774 0.321 . . . . 0.0 111.782 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.653 HG11 ' HB2' ' A' ' 46' ' ' LYS . 4.8 p -126.66 116.72 45.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.805 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.743 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -127.41 139.54 52.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.336 -179.482 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.429 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -95.11 117.66 39.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.36 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.5 p -122.31 104.62 9.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.68 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.61 -65.94 0.57 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.975 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.471 HG22 ' H ' ' A' ' 59' ' ' GLY . 0.2 OUTLIER 60.45 -176.98 0.11 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.899 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.471 ' H ' HG22 ' A' ' 58' ' ' THR . . . -123.4 165.7 16.05 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.477 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 m -176.67 119.68 0.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.852 0.358 . . . . 0.0 110.866 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.04 -65.78 0.97 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.847 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -138.62 31.63 2.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.932 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 60.1 -139.8 48.22 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.462 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 127.28 -39.93 1.85 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.504 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.91 124.66 30.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.825 0.345 . . . . 0.0 110.887 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 111.04 28.16 3.98 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.45 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.586 HD12 ' HB2' ' A' ' 68' ' ' SER . 4.5 pp -153.83 160.32 42.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.819 0.342 . . . . 0.0 110.848 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.586 ' HB2' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER 68.55 -68.09 0.19 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.872 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.1 mttp -114.25 110.16 19.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.882 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.432 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER 179.28 -53.4 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.896 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.432 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 34.7 Cg_exo -57.61 -161.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.516 2.144 . . . . 0.0 112.243 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -91.9 175.96 6.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.069 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -96.67 137.56 13.41 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.41 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.5 p -107.98 179.37 4.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.793 0.33 . . . . 0.0 110.93 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -171.47 163.31 6.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.925 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 63.47 15.81 9.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.46 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 176.89 -179.48 0.19 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.824 0.345 . . . . 0.0 110.931 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mtpp -139.87 84.38 1.97 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.733 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -140.05 159.21 42.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.431 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -92.34 139.91 30.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.915 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.431 ' H ' HD13 ' A' ' 80' ' ' LEU . 61.0 mtp85 61.79 148.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.937 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -173.03 35.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -96.37 133.21 25.18 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.749 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.99 111.65 3.38 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.494 2.129 . . . . 0.0 112.351 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -56.43 -24.81 54.43 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.472 2.115 . . . . 0.0 112.27 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.1 m 63.34 -79.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.983 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -146.04 99.14 3.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.928 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -165.51 -45.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.819 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.491 HD22 ' N ' ' A' ' 89' ' ' LEU . 3.1 mm? -91.4 -32.44 15.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -48.93 -43.65 39.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.633 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.0 m -61.99 -14.19 32.88 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.533 ' CD1' ' CE2' ' A' ' 121' ' ' PHE . 24.0 m-85 -114.13 104.8 12.48 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.819 0.343 . . . . 0.0 110.644 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.409 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.2 OUTLIER -84.48 -86.58 0.12 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.164 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.798 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 11.3 t -148.25 -56.61 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.775 0.321 . . . . 0.0 111.305 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.44 -20.18 61.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.963 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -20.88 42.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.124 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.69 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -78.4 -58.56 3.19 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.401 -179.619 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.798 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.3 ptpt -62.14 -25.68 67.88 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.274 179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.76 -29.55 25.38 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.021 0.438 . . . . 0.0 112.164 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 29.0 mt-30 -86.72 -29.4 22.43 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.738 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.852 HD22 ' HB ' ' A' ' 106' ' ' ILE . 6.0 mt -67.05 -46.29 74.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.22 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.729 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -64.5 -40.24 95.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.988 179.553 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.97 -6.81 49.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.087 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.3 mtt-85 -106.44 -15.3 14.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.957 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.93 64.45 1.42 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.841 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.852 ' HB ' HD22 ' A' ' 101' ' ' LEU . 18.1 mt -151.16 100.49 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.66 0.267 . . . . 0.0 111.167 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -57.18 122.25 12.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.84 0.352 . . . . 0.0 110.921 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.729 ' HE1' HG23 ' A' ' 102' ' ' THR . 13.8 p90 -130.56 5.54 4.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.547 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -99.14 31.48 3.03 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 0.0 110.91 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.38 25.97 0.6 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.5 p 177.19 -37.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.914 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.466 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -82.99 175.89 9.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.3 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.552 ' O ' HD13 ' A' ' 117' ' ' LEU . 25.0 p -150.55 -80.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.843 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.748 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.5 pttt -145.35 -46.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.458 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.59 -25.2 41.6 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.005 0.431 . . . . 0.0 110.264 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.14 -36.73 19.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.401 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.925 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -79.7 -19.42 48.96 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.054 -179.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.925 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.74 -30.18 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 120.874 0.369 . . . . 0.0 110.268 178.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.83 -32.38 19.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.286 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.837 HD11 HD21 ' A' ' 101' ' ' LEU . 1.5 pp -72.5 -17.11 61.77 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.633 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -20.46 91.18 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.405 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . 64.35 86.55 0.14 Allowed Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.137 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.459 ' CD ' HD13 ' A' ' 106' ' ' ILE . 64.5 Cg_endo -73.66 61.25 4.45 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.551 2.167 . . . . 0.0 112.328 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 67.58 -71.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.092 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -78.32 146.36 34.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 116.88 105.99 2.42 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.541 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -141.72 -49.44 0.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.9 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -170.15 158.3 6.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.9 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 37.8 m -133.9 150.31 51.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -139.02 36.24 2.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.892 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.094 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.527 -0.229 . . . . 0.0 112.527 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.9 t -75.48 -67.73 0.63 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.84 0.352 . . . . 0.0 110.913 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -163.91 93.18 0.71 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -80.85 137.96 36.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.768 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -174.45 -40.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.081 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.53 76.86 3.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.119 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.75 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 9.5 t -162.16 130.03 4.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.647 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.07 146.03 29.85 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 3.4 m -94.63 115.86 28.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.879 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -110.27 151.74 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.131 0.491 . . . . 0.0 112.061 -178.312 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.562 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.3 p -138.08 128.2 35.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.151 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.062 HG13 HD13 ' A' ' 45' ' ' LEU . 23.4 m -96.78 104.81 16.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.921 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.94 106.53 18.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.024 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.916 ' CB ' HD22 ' A' ' 51' ' ' LEU . 21.8 p-10 -105.47 121.95 45.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.089 0.471 . . . . 0.0 112.185 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -105.49 25.91 10.14 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.675 HG22 ' HG2' ' A' ' 17' ' ' LYS . 6.1 mt -87.27 -60.13 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.576 -178.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.675 ' HG2' HG22 ' A' ' 16' ' ' ILE . 29.1 pttt -176.71 -172.62 0.45 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.669 0.271 . . . . 0.0 111.111 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.422 ' HB3' ' HB2' ' A' ' 29' ' ' LEU . 12.2 pt-20 -113.57 13.33 18.74 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.952 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.61 -20.44 10.12 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.373 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.516 ' O ' ' HB2' ' A' ' 27' ' ' PHE . 2.0 t80 -69.05 99.05 1.04 Allowed 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.198 0.523 . . . . 0.0 109.833 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 27.9 ptt180 -176.36 -178.18 0.93 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.713 -178.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.477 ' HB2' ' HB2' ' A' ' 26' ' ' SER . 0.6 OUTLIER -76.73 -50.59 13.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.046 0.45 . . . . 0.0 110.225 179.42 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -178.04 34.85 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.577 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 93.73 15.66 48.65 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.254 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.75 44.08 1.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.934 0.397 . . . . 0.0 110.627 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -160.1 -38.3 0.05 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.518 -179.776 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.516 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 71.8 m-85 -156.03 159.05 38.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.028 0.442 . . . . 0.0 111.668 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.421 ' CG ' ' O ' ' A' ' 27' ' ' PHE . 22.0 m-70 -160.23 173.67 15.38 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.365 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 18' ' ' GLU . 21.4 tp -75.9 99.92 4.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.001 0.429 . . . . 0.0 110.66 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.57 -139.9 6.48 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.234 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.422 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -136.45 122.86 20.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.005 0.431 . . . . 0.0 111.114 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.0 t30 -107.1 122.0 45.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.871 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.1 p -86.7 145.45 26.68 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.538 0.685 . . . . 0.0 111.544 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.934 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -117.2 139.12 51.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.25 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.934 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.85 156.93 38.96 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 120.825 0.345 . . . . 0.0 110.102 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.75 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.23 107.07 3.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.474 0.654 . . . . 0.0 111.544 -177.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.695 HG23 ' N ' ' A' ' 38' ' ' SER . 0.6 OUTLIER -124.66 -175.91 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.296 -179.401 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.695 ' N ' HG23 ' A' ' 37' ' ' VAL . 16.4 m -51.68 -68.02 0.2 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.528 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -176.1 -21.43 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.4 -35.23 0.97 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.882 0.372 . . . . 0.0 111.478 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.733 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.22 -39.03 69.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.52 179.81 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.496 HD13 ' CG2' ' A' ' 55' ' ' ILE . 6.1 tp -70.58 -39.67 73.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.775 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.47 -27.37 56.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.53 -45.02 66.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.009 0.433 . . . . 0.0 110.491 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 1.062 HD13 HG13 ' A' ' 12' ' ' VAL . 51.4 mt -78.7 -30.6 46.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.014 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -69.84 -19.65 63.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.224 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.14 -55.01 27.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.38 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.41 118.65 64.38 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.999 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -81.85 54.7 5.17 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.632 2.221 . . . . 0.0 112.394 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.56 ' CG ' HD13 ' A' ' 16' ' ' ILE . 3.4 tpt180 -149.14 -63.28 0.23 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.719 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.916 HD22 ' CB ' ' A' ' 14' ' ' ASN . 18.1 mt -63.66 175.93 0.99 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.489 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.504 ' O ' HG23 ' A' ' 52' ' ' VAL . 3.4 m -120.55 123.06 69.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.493 HG22 HD12 ' A' ' 42' ' ' LEU . 2.0 p -116.9 106.28 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 0.0 110.299 178.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.517 ' O ' HG22 ' A' ' 10' ' ' VAL . 5.0 mt-30 -127.48 131.21 50.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.021 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.879 ' HA ' HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -88.07 119.24 35.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.264 0.554 . . . . 0.0 111.622 -179.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 p -122.79 104.61 9.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.466 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 59' ' ' GLY . 6.4 tt0 -74.4 61.5 0.92 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.036 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.7 m 63.92 -74.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.116 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 57' ' ' GLU . . . 134.41 84.79 0.22 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.278 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.4 m 63.46 117.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.739 0.304 . . . . 0.0 110.701 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 61.89 150.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.881 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -119.8 167.75 11.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.898 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 111.37 -109.61 2.56 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.46 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -127.03 145.95 16.07 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.528 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -135.03 36.13 3.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.863 0.363 . . . . 0.0 110.889 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 152.14 109.11 0.4 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.527 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -88.41 -72.94 0.51 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.813 0.34 . . . . 0.0 110.811 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.6 m -93.67 146.92 23.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.865 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.05 122.68 1.59 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.962 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -166.84 166.19 8.9 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.852 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -83.81 42.69 1.26 Allowed 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 123.101 2.534 . . . . 0.0 112.703 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 54.15 101.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.821 0.343 . . . . 0.0 111.372 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.05 80.69 0.82 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.456 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 t -111.26 -57.41 2.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.749 0.309 . . . . 0.0 110.917 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.35 -175.58 3.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -99.38 -75.99 0.55 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.4 -40.39 2.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.969 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? 63.43 41.18 7.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.86 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.679 ' C ' HD23 ' A' ' 80' ' ' LEU . 4.7 mt-30 -155.65 -173.92 4.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.855 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.679 HD23 ' C ' ' A' ' 79' ' ' GLN . 0.9 OUTLIER 46.11 -169.34 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.364 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.17 173.45 6.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -154.84 152.32 29.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.122 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.4 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.7 OUTLIER -114.03 136.82 22.2 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.771 179.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.463 ' N ' ' CD ' ' A' ' 85' ' ' PRO . 31.8 Cg_exo -57.72 -46.76 24.64 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.261 1.974 . . . . 0.0 112.428 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 84' ' ' PRO . 42.3 Cg_exo -56.65 -38.68 95.08 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.394 2.063 . . . . 0.0 112.255 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.6 m -94.19 169.04 10.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.978 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.9 t -178.47 -39.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.705 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.401 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 18.4 p30 -166.89 151.51 7.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.669 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.401 ' CB ' ' O ' ' A' ' 88' ' ' ASP . 0.6 OUTLIER 80.26 -49.48 0.34 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -48.86 -47.34 42.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.475 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.9 p -62.14 -12.78 21.52 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -115.46 122.43 45.73 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.674 0.273 . . . . 0.0 110.435 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.438 ' N ' HD11 ' A' ' 97' ' ' LEU . 93.5 m -84.75 -98.69 0.06 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.48 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.778 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 43.3 t -142.31 -56.84 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.075 0 CA-C-O 120.816 0.341 . . . . 0.0 111.361 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.25 -20.13 61.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.819 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.52 -21.18 38.76 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.083 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.768 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.2 OUTLIER -75.35 -58.74 3.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.357 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.86 ' O ' HG23 ' A' ' 102' ' ' THR . 1.8 ptpt -57.82 -26.9 62.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.95 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.09 29.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.044 0.45 . . . . 0.0 111.663 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -86.79 -38.28 17.02 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 101' ' ' LEU . 22.8 mt -63.83 -42.64 97.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.662 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.86 HG23 ' O ' ' A' ' 98' ' ' LYS . 12.7 p -65.73 -40.82 92.56 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.113 0.482 . . . . 0.0 109.907 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.33 -6.91 50.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.348 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 36.6 mtt180 -106.03 -15.27 14.94 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.158 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.35 42.25 5.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.598 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 23.4 mm -128.41 92.27 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.714 0.293 . . . . 0.0 111.201 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 p -57.75 151.13 18.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.847 0.356 . . . . 0.0 110.864 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.66 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 2.3 p90 -153.5 36.66 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.017 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -45.41 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -134.72 24.47 3.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.005 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 -33.58 4.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.993 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.66 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -139.67 119.64 13.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.142 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.499 ' O ' HD13 ' A' ' 117' ' ' LEU . 68.6 p -92.21 -73.53 0.55 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.693 ' O ' HG22 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -145.25 -40.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -24.05 32.77 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.5 mm-40 -86.08 -38.46 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.434 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.922 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -76.25 -19.91 57.9 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.587 -0.278 . . . . 0.0 111.213 -179.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.922 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.6 -33.17 12.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.249 -0.58 . . . . 0.0 109.582 177.927 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.43 -28.28 22.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.462 ' O ' ' N ' ' A' ' 122' ' ' ALA . 18.5 tp -48.77 -43.79 38.17 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.252 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.55 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 9.2 m-85 -45.42 90.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.535 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.462 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -116.24 154.71 48.76 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.973 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -65.22 -177.57 0.66 Allowed 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.564 2.176 . . . . 0.0 112.198 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -58.44 111.69 1.32 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.058 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -114.16 -179.95 3.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.875 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 133.27 -172.14 21.6 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.589 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -125.43 64.95 1.16 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.869 0.366 . . . . 0.0 110.946 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.1 mttt 60.07 159.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 66.47 -73.47 0.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.936 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 63.44 99.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.87 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.316 -0.85 . . . . 0.0 111.104 179.983 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.528 -0.229 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -130.15 93.98 3.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.869 0.366 . . . . 0.0 110.841 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.4 m-70 -119.85 -40.92 2.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.954 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -159.76 -44.54 0.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.895 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -84.77 151.75 24.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.021 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 48.8 tttm -176.81 38.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.72 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.92 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -158.8 139.43 12.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.695 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.81 145.68 31.76 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.8 p -94.12 133.15 37.92 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.738 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -109.98 148.3 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.522 0.677 . . . . 0.0 111.85 -178.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.9 p -138.15 101.18 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.958 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.068 HG21 HD22 ' A' ' 45' ' ' LEU . 78.9 t -92.6 136.71 24.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.196 -178.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -119.3 112.45 19.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.572 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 141.56 29.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.05 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.445 ' HA ' HD22 ' A' ' 29' ' ' LEU . 1.2 ptt180 -141.09 31.52 1.76 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.385 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.592 HG22 ' CG ' ' A' ' 17' ' ' LYS . 2.2 mp -99.65 -59.61 3.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.178 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.592 ' CG ' HG22 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -160.75 179.15 8.77 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.51 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -109.2 2.5 20.99 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.766 0.317 . . . . 0.0 111.039 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.94 -13.02 54.62 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.351 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.477 ' HD2' HD11 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -86.8 102.63 14.46 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.438 0.637 . . . . 0.0 109.889 179.604 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptt180 -139.72 143.44 37.03 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.266 -178.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.466 ' O ' ' CE1' ' A' ' 27' ' ' PHE . 1.5 ttm105 177.2 -165.36 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.931 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.41 64.92 8.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.892 0.377 . . . . 0.0 111.017 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.84 -38.08 3.23 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.234 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.528 ' O ' HD21 ' A' ' 51' ' ' LEU . 89.7 m-85 -62.19 -19.01 62.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.688 0.28 . . . . 0.0 111.119 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.416 ' HB3' ' CG ' ' A' ' 20' ' ' TYR . 5.5 m -165.67 148.86 7.8 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.597 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.466 ' CE1' ' O ' ' A' ' 22' ' ' ARG . 2.1 m-30 -154.64 161.65 41.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.947 0.403 . . . . 0.0 111.176 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -60.18 -179.7 0.12 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.555 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 15' ' ' ARG . 15.1 mt -84.09 103.5 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.18 0.514 . . . . 0.0 110.987 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 170.21 -144.1 8.24 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.34 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -147.92 128.36 14.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.858 0.361 . . . . 0.0 110.998 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.4 p-10 -124.75 133.12 53.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.21 145.61 26.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.069 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.943 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -113.33 143.07 45.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.191 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.943 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.62 156.72 39.09 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-O 121.091 0.472 . . . . 0.0 110.402 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.92 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.24 115.64 9.67 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.415 0.626 . . . . 0.0 111.551 -177.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.626 HG23 ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -129.72 -173.24 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.958 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.626 ' N ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -65.35 -59.19 4.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.552 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -171.2 -16.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.1 m -42.23 -40.82 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.745 HE22 HG22 ' A' ' 55' ' ' ILE . 0.0 OUTLIER -57.37 -43.04 83.2 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.216 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.557 HD13 HG23 ' A' ' 55' ' ' ILE . 19.7 tp -64.52 -55.36 21.11 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.194 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.736 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.99 -23.14 62.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.537 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.25 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.861 0.362 . . . . 0.0 110.276 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 1.068 HD22 HG21 ' A' ' 12' ' ' VAL . 0.8 OUTLIER -78.93 -57.47 3.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.931 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.487 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -51.85 -23.27 4.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.609 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.736 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -43.37 -31.43 0.67 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.781 0.324 . . . . 0.0 111.498 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.04 128.01 24.59 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.683 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.95 77.42 2.73 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.426 2.084 . . . . 0.0 112.22 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.61 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -146.54 -45.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.184 -179.846 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.61 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -110.61 124.8 52.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.974 0.416 . . . . 0.0 110.827 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.413 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.0 t -64.7 106.06 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.625 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.828 ' HA ' HG22 ' A' ' 12' ' ' VAL . 2.9 p -99.03 123.97 51.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.147 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.738 ' O ' HG22 ' A' ' 10' ' ' VAL . 19.8 pt20 -127.0 141.09 51.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.081 -178.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.745 HG22 HE22 ' A' ' 41' ' ' GLN . 1.0 OUTLIER -100.58 112.7 34.15 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.039 179.539 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 56' ' ' THR . 3.3 t -122.42 104.67 9.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.609 ' O ' HG23 ' A' ' 58' ' ' THR . 0.7 OUTLIER -98.02 62.06 1.54 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.839 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.609 HG23 ' O ' ' A' ' 57' ' ' GLU . 2.4 p -162.66 174.76 12.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.876 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 104.34 165.2 24.64 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.523 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.6 m -135.45 80.04 1.81 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.828 0.347 . . . . 0.0 110.926 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -153.09 141.55 20.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.881 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -102.87 117.23 34.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.927 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.61 175.91 19.13 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.536 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.782 ' HA3' HD12 ' A' ' 67' ' ' LEU . . . -144.19 -58.42 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.526 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 60.6 30.97 20.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.53 68.44 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.782 HD12 ' HA3' ' A' ' 64' ' ' GLY . 0.6 OUTLIER -110.57 24.73 12.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.674 0.274 . . . . 0.0 110.909 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.7 m -165.18 175.94 8.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.954 0.407 . . . . 0.0 110.796 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -115.11 -38.9 3.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.793 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -164.35 141.54 5.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.38 -61.9 0.4 Allowed 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.482 2.121 . . . . 0.0 112.271 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.01 -47.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.065 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.91 -86.94 0.34 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.475 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.0 p 49.67 88.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.82 0.343 . . . . 0.0 111.216 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 63.63 135.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -118.29 -36.3 3.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.068 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.473 ' NE2' HD12 ' A' ' 80' ' ' LEU . 8.2 mt-30 -119.19 179.97 4.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.924 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.84 55.29 0.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.815 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 63.06 142.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.948 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.473 HD12 ' NE2' ' A' ' 77' ' ' GLN . 8.0 mt -147.61 78.73 1.47 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.869 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.86 148.92 50.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.768 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -177.12 -37.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.271 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.2 t0 69.77 78.94 0.22 Allowed Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.882 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.482 ' N ' ' HD2' ' A' ' 85' ' ' PRO . 2.3 Cg_endo -42.8 -57.65 1.62 Allowed 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.919 2.413 . . . . 0.0 112.828 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 84' ' ' PRO . 19.5 Cg_endo -59.43 -70.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.27 1.98 . . . . 0.0 112.245 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.6 t 63.47 131.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.985 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.4 m 59.48 160.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.953 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.445 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 4.9 m-20 58.58 165.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 2.3 mm? 70.1 -46.26 0.6 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.824 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -48.44 -45.02 35.91 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.565 0.221 . . . . 0.0 111.288 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 p -62.11 -13.21 24.48 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.404 ' HB3' HD12 ' A' ' 97' ' ' LEU . 5.7 m-85 -90.07 115.61 27.47 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.681 0.277 . . . . 0.0 110.427 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.785 HG22 HG22 ' A' ' 94' ' ' VAL . 90.4 m -91.22 -107.46 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.778 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.822 ' HA ' HD21 ' A' ' 97' ' ' LEU . 10.0 m -135.61 -32.02 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.25 0 CA-C-O 120.916 0.389 . . . . 0.0 111.494 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -83.58 -20.0 34.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.736 0.303 . . . . 0.0 111.068 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.6 OUTLIER -81.53 -32.61 32.21 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -177.571 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.832 HD13 ' H ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -77.87 -50.03 13.07 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -179.788 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.568 ' H ' HD22 ' A' ' 97' ' ' LEU . 3.3 ptpt -62.24 -28.11 69.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.86 -30.39 24.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.963 0.411 . . . . 0.0 111.98 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -86.82 -27.9 23.24 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.675 HD22 HG21 ' A' ' 106' ' ' ILE . 6.5 mt -64.73 -47.23 79.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.261 0.553 . . . . 0.0 109.742 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -34.83 74.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.749 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.28 -12.57 61.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.314 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.57 ' HD3' HD23 ' A' ' 101' ' ' LEU . 9.6 ptm180 -110.89 -15.26 13.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.052 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.05 82.72 0.79 Allowed Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.791 -0.718 . . . . 0.0 113.16 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.675 HG21 HD22 ' A' ' 101' ' ' LEU . 8.4 tp -126.74 -40.83 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.698 0.285 . . . . 0.0 111.376 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.431 ' N ' HG23 ' A' ' 106' ' ' ILE . 0.2 OUTLIER 73.65 90.83 0.09 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.846 0.355 . . . . 0.0 110.624 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.91 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 14.1 p90 -115.26 139.03 50.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.114 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -43.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.788 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -128.22 27.41 5.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.67 30.27 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.97 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.91 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -178.46 59.67 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.015 0.436 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.607 ' O ' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -59.79 -83.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.7 ' HA ' HD22 ' A' ' 117' ' ' LEU . 4.3 ptpt -139.62 -43.79 0.44 Allowed 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.812 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.86 -24.5 41.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.998 0.428 . . . . 0.0 110.253 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -86.19 -36.55 19.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.837 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.93 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.97 -21.57 50.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.375 -179.145 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.93 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.12 -27.54 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.148 177.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.21 -34.17 19.09 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.143 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 122' ' ' ALA . 0.7 OUTLIER -49.33 -46.26 46.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.871 -179.003 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.613 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 53.0 m-85 -54.68 86.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.399 . . . . 0.0 111.348 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.44 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -127.88 152.64 77.55 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.946 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.94 92.41 0.21 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.595 2.196 . . . . 0.0 112.278 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -130.08 138.11 50.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.093 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 8.8 t70 60.15 160.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 151.16 44.68 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.491 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -80.75 169.87 17.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.829 0.347 . . . . 0.0 110.918 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 7.5 tptt -155.62 -51.27 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.857 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.1 121.37 14.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -149.91 97.46 2.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.882 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.048 179.995 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.14 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m -110.33 106.35 15.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.825 0.345 . . . . 0.0 110.834 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -108.45 159.22 16.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.009 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 20.5 ptm 42.56 87.61 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.535 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.14 110.21 7.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.904 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.45 99.58 2.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.989 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.787 HG22 ' C ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -84.86 135.95 33.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.598 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.472 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.15 146.46 31.79 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.523 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.3 p -96.9 119.81 36.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.755 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.76 151.55 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.176 0.513 . . . . 0.0 111.633 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.564 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 6.1 p -134.94 126.27 46.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.086 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.065 HG13 HD13 ' A' ' 45' ' ' LEU . 9.0 m -95.86 104.77 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.341 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -88.82 106.56 18.46 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.846 ' HB2' HD12 ' A' ' 16' ' ' ILE . 1.0 OUTLIER -98.22 144.11 28.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.447 0.641 . . . . 0.0 111.946 -179.294 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.617 ' HG3' HD21 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -139.12 35.29 2.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.607 178.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.846 HD12 ' HB2' ' A' ' 14' ' ' ASN . 2.8 mp -77.02 -61.81 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.578 -178.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.836 ' HG2' HG22 ' A' ' 16' ' ' ILE . 11.8 ptpt 177.39 32.32 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.43 ' HA ' ' N ' ' A' ' 29' ' ' LEU . 0.1 OUTLIER 51.89 26.0 3.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.715 0.293 . . . . 0.0 111.274 179.608 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -179.07 77.52 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.354 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.424 ' CE2' ' HG2' ' A' ' 50' ' ' ARG . 41.7 t80 -150.17 32.73 0.66 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.923 0.392 . . . . 0.0 110.934 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.5 mmt-85 60.56 170.69 0.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.609 179.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.527 ' HG2' HD22 ' A' ' 51' ' ' LEU . 1.4 tmm_? 179.92 -70.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.819 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.58 13.19 30.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.141 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.44 29.32 3.98 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.85 -0.691 . . . . 0.0 111.395 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.25 162.04 8.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.672 -0.264 . . . . 0.0 110.398 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.12 80.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.768 0.318 . . . . 0.0 110.682 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.427 ' CZ ' ' HB2' ' A' ' 32' ' ' ASN . 5.8 t80 -60.78 128.47 36.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.896 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -69.45 155.2 40.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.64 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.617 HD21 ' HG3' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -64.03 94.57 0.1 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.157 0.503 . . . . 0.0 110.511 179.902 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -167.36 -133.45 1.54 Allowed Glycine 0 N--CA 1.45 -0.433 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.871 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.559 ' HB2' HG22 ' A' ' 11' ' ' VAL . 36.4 p-10 -157.09 142.14 17.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.908 0.385 . . . . 0.0 111.483 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.8 t-20 -122.01 136.46 54.92 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.083 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.02 145.2 26.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.492 0.663 . . . . 0.0 111.715 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.938 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -111.97 141.44 45.63 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.885 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.938 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.39 157.58 37.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.393 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.787 ' C ' HG22 ' A' ' 7' ' ' THR . . . -69.5 112.02 5.73 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.622 0.725 . . . . 0.0 111.243 -177.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.543 ' N ' HG22 ' A' ' 7' ' ' THR . 5.3 t -127.84 168.62 20.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.64 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.525 ' H ' HG12 ' A' ' 37' ' ' VAL . 19.4 t -54.36 -62.07 1.9 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.525 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -164.92 -16.61 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.42 -45.27 4.31 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.498 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -53.4 -47.04 69.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.801 0.334 . . . . 0.0 111.693 -179.619 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.437 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 8.7 tp -57.89 -46.56 84.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.518 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.18 -28.44 48.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.661 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -50.69 67.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.938 0.399 . . . . 0.0 110.712 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 1.065 HD13 HG13 ' A' ' 12' ' ' VAL . 32.4 mt -79.0 -34.3 44.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.414 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.57 ' N ' HG11 ' A' ' 53' ' ' VAL . 1.7 ttmt -77.7 -10.27 59.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.322 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.47 -45.54 73.19 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.717 0.294 . . . . 0.0 111.261 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -93.28 127.95 44.7 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -79.31 85.79 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.518 2.145 . . . . 0.0 112.565 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.424 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -167.13 -72.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.855 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.651 ' HG ' HD11 ' A' ' 16' ' ' ILE . 6.1 mp -64.47 171.03 3.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.609 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.5 t -115.35 106.75 21.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.927 0.394 . . . . 0.0 111.908 -179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.57 HG11 ' N ' ' A' ' 46' ' ' LYS . 1.3 p -104.02 111.19 32.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.05 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.508 ' O ' HG22 ' A' ' 10' ' ' VAL . 2.3 mm-40 -127.17 133.54 50.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.523 -179.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.755 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.31 133.37 30.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.119 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.3 p -122.27 104.57 9.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.792 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -61.89 1.35 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.909 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.3 t -153.1 -46.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.885 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.3 -161.51 30.17 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.534 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.29 -36.65 20.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.878 0.37 . . . . 0.0 110.984 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -174.62 -60.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -175.21 -56.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.953 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 94.92 146.43 20.72 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.54 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -166.18 47.47 0.27 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.473 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -126.78 41.81 3.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.923 0.392 . . . . 0.0 110.856 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 133.64 -28.43 3.25 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.51 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.2 tt -95.5 113.1 24.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 110.908 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.73 -76.8 0.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.856 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm -149.65 -47.98 0.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.954 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -117.84 113.25 38.04 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.866 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -77.12 -0.99 11.14 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.494 2.129 . . . . 0.0 112.807 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -52.96 -76.17 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.806 0.336 . . . . 0.0 111.289 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 142.34 -53.94 0.62 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.497 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.81 32.56 18.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.787 0.327 . . . . 0.0 110.914 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.72 -48.56 3.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.868 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.37 158.57 25.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.907 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -143.25 -48.82 0.32 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.17 174.36 10.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.5 105.04 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.875 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.552 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -118.09 142.03 47.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.552 ' H ' HD13 ' A' ' 80' ' ' LEU . 4.7 ttt85 -61.35 -176.15 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -94.07 170.75 9.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.096 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.55 145.84 50.54 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -51.81 104.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.632 2.221 . . . . 0.0 112.292 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -65.98 69.36 0.4 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.674 2.249 . . . . 0.0 112.161 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.8 p -159.11 109.02 1.95 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.928 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 39.0 m -144.77 -47.12 0.24 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.903 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -141.0 -46.94 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.877 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.463 ' HA ' HD12 ' A' ' 89' ' ' LEU . 8.7 tp -62.38 -18.7 62.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.294 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -49.17 -50.25 38.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.655 0.265 . . . . 0.0 111.125 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.22 -10.18 14.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.439 ' CD1' ' HA ' ' A' ' 89' ' ' LEU . 4.4 m-85 -88.29 120.92 30.11 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.6 0.238 . . . . 0.0 110.528 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.6 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -133.8 -91.48 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.876 ' HA ' HD21 ' A' ' 97' ' ' LEU . 20.4 t -131.39 -44.58 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-O 121.027 0.441 . . . . 0.0 111.65 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.428 ' O ' ' HB3' ' A' ' 99' ' ' ALA . 5.7 pt-20 -82.29 -19.99 38.39 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -85.72 -29.29 24.04 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.876 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -84.59 -55.24 4.23 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.453 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.802 ' HE2' HD11 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -55.13 -32.83 62.37 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.794 178.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 95' ' ' GLU . . . -85.36 -24.85 27.42 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.989 0.423 . . . . 0.0 112.086 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 71.5 mt-30 -86.57 -45.29 11.2 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.923 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.531 HD22 ' HB ' ' A' ' 106' ' ' ILE . 4.7 mt -50.89 -49.05 60.16 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.994 0.426 . . . . 0.0 110.38 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.589 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -66.66 -38.27 86.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.113 179.599 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -77.17 -6.69 53.92 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.333 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -104.07 -15.18 15.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.215 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.57 ' O ' HD13 ' A' ' 106' ' ' ILE . . . 88.98 47.02 4.3 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.549 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.57 HD13 ' O ' ' A' ' 105' ' ' GLY . 21.7 mm -133.38 91.21 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 0.0 111.078 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 27.3 p -54.64 119.82 5.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.953 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.589 ' HE1' HG23 ' A' ' 102' ' ' THR . 14.6 p90 -117.5 74.24 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.873 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.29 39.81 2.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.759 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -121.49 -47.03 2.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.013 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.16 33.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.039 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -116.66 90.1 3.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.987 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.84 -76.67 0.15 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.04 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.541 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -147.21 -39.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.417 ' HA ' HG22 ' A' ' 118' ' ' ILE . . . -77.57 -22.12 51.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 110.658 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 12.7 mm-40 -85.58 -37.96 18.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.85 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.864 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -82.37 -19.89 38.28 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.302 -179.527 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.864 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.64 -25.24 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.589 177.749 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.72 -35.38 19.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.392 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -33.51 74.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.456 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 0.8 OUTLIER -60.29 84.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.258 -179.702 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.53 126.7 90.74 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.844 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.91 151.35 84.34 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.424 2.083 . . . . 0.0 112.353 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -99.84 136.92 39.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.094 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -176.77 -40.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.847 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -109.75 -110.94 3.35 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.483 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 43.73 60.43 2.67 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 111.399 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -96.93 88.1 4.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.97 102.24 3.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.808 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -122.78 117.81 26.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.962 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.215 179.965 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.0 p -86.05 161.63 18.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.772 0.32 . . . . 0.0 111.016 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -144.3 158.26 43.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.901 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 ttm -100.66 171.77 7.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.837 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 61.89 73.88 0.46 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.148 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.07 65.85 0.92 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.387 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.913 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -165.68 147.5 7.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.467 -179.36 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.46 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -144.9 135.29 24.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.675 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -89.74 119.98 30.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.835 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.88 156.0 10.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.905 0.383 . . . . 0.0 111.759 -177.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 2.5 p -138.22 117.48 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.069 0.461 . . . . 0.0 110.718 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.846 HG21 ' NH2' ' A' ' 22' ' ' ARG . 27.1 m -93.14 110.37 23.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.166 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -91.86 111.54 23.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.49 144.48 26.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.301 0.572 . . . . 0.0 111.595 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.645 ' HA ' HD22 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -143.06 33.99 1.36 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.792 179.139 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.626 HG22 ' HG3' ' A' ' 17' ' ' LYS . 3.2 mp -99.27 -58.3 3.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.589 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.626 ' HG3' HG22 ' A' ' 16' ' ' ILE . 2.9 mttt -151.86 -178.54 6.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.632 0.253 . . . . 0.0 110.862 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.83 37.78 1.87 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.897 0.379 . . . . 0.0 110.776 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.12 74.88 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.28 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.565 ' O ' ' HD2' ' A' ' 21' ' ' ARG . 3.1 t80 -132.08 98.82 4.53 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.806 0.336 . . . . 0.0 110.365 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.565 ' HD2' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 47.41 175.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.697 179.611 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.846 ' NH2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER 71.52 178.28 0.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.139 -178.696 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.574 ' HB2' ' CD2' ' A' ' 27' ' ' PHE . . . 59.93 11.82 2.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.448 -178.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.438 ' O ' ' HB3' ' A' ' 25' ' ' PHE . . . 83.98 14.01 73.33 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.974 -0.632 . . . . 0.0 112.223 -179.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.438 ' HB3' ' O ' ' A' ' 24' ' ' GLY . 0.2 OUTLIER 178.21 -46.51 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.48 ' HA ' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER 174.54 118.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.252 -179.449 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.574 ' CD2' ' HB2' ' A' ' 23' ' ' ALA . 2.0 t80 -85.36 156.41 20.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.344 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -85.07 175.77 8.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.098 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.645 HD22 ' HA ' ' A' ' 15' ' ' ARG . 8.4 mt -65.75 93.45 0.18 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.046 0.451 . . . . 0.0 110.638 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -168.41 -139.41 2.69 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.55 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 22.8 p-10 -152.41 146.95 25.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.841 0.353 . . . . 0.0 111.007 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.431 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 0.9 OUTLIER -125.0 135.48 52.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.411 179.795 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.5 m -87.11 145.5 26.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.343 0.592 . . . . 0.0 111.069 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.918 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -114.26 140.2 48.78 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.981 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.918 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.17 157.55 37.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.005 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.913 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.38 106.43 2.93 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.769 0.795 . . . . 0.0 111.168 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 35' ' ' ALA . 5.0 t -124.53 167.61 18.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 114.36 -1.291 . . . . 0.0 110.705 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.506 ' N ' HG12 ' A' ' 37' ' ' VAL . 0.7 OUTLIER -55.51 -64.95 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.433 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -160.25 -16.37 0.05 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.6 m -42.19 -38.14 1.65 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.73 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -63.22 -53.38 54.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.911 0.386 . . . . 0.0 111.309 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.423 ' N ' ' NE2' ' A' ' 41' ' ' GLN . 5.0 tp -57.78 -28.31 63.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.511 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -90.41 -40.47 12.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.683 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.6 tm0? -62.21 -40.73 97.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.808 0.337 . . . . 0.0 110.756 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.772 HD12 ' CG2' ' A' ' 53' ' ' VAL . 7.3 mt -78.84 -39.83 34.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.257 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.0 tmmm? -65.98 -12.89 58.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.537 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.46 -28.84 2.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.681 0.277 . . . . 0.0 111.504 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -129.48 110.02 17.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.13 -22.66 11.32 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.655 2.237 . . . . 0.0 112.654 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -45.79 -63.7 0.91 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.879 0.371 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.02 170.4 16.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.745 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.8 t -119.44 108.28 23.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.884 0.373 . . . . 0.0 111.679 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.772 ' CG2' HD12 ' A' ' 45' ' ' LEU . 1.5 p -105.89 111.32 34.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.494 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.546 ' O ' HG22 ' A' ' 10' ' ' VAL . 16.0 mt-30 -127.52 130.9 49.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.583 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.835 ' HA ' HG23 ' A' ' 10' ' ' VAL . 2.6 pp -88.13 145.35 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.064 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.1 p -122.26 104.55 9.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.684 179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.39 84.65 1.47 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.708 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.9 p -47.74 95.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.207 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 154.87 -64.41 0.33 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.86 -0.685 . . . . 0.0 112.407 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.5 t 62.66 -80.03 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.756 0.312 . . . . 0.0 111.132 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -118.81 168.88 10.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.866 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -79.43 81.16 5.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.896 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.46 141.54 11.03 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.479 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 143.15 -149.81 21.72 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.475 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.7 mp0 61.14 114.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.91 0.386 . . . . 0.0 110.873 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 178.28 -36.14 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.483 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.55 -30.95 70.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.767 0.318 . . . . 0.0 110.788 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.5 m 60.67 177.23 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.767 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB3' ' HD2' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -71.63 -72.43 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.851 179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.448 ' CB ' ' HD3' ' A' ' 71' ' ' PRO . 1.6 mt-10 172.34 -53.84 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.215 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.448 ' HD3' ' CB ' ' A' ' 70' ' ' GLU . 28.0 Cg_exo -62.08 168.77 8.59 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.472 2.114 . . . . 0.0 112.289 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.48 -38.65 3.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.137 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -87.41 162.08 33.07 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.539 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 m -96.4 85.29 3.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.859 0.362 . . . . 0.0 110.915 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -114.46 -37.1 4.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.889 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 61.74 -169.11 0.18 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.855 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 61.33 170.64 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 173.36 12.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.871 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.63 62.07 5.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.962 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.8 tp -169.24 98.03 0.35 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.852 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -164.27 136.67 4.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.976 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -171.06 -59.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.968 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -128.56 138.11 32.38 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.759 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.31 111.27 3.23 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.533 2.155 . . . . 0.0 112.462 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -77.58 -25.01 8.44 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.489 2.126 . . . . 0.0 112.302 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.86 -47.22 77.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.173 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.1 m -88.41 72.03 8.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.951 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -138.3 -56.86 0.65 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.702 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.0 tp -70.89 -17.76 62.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.11 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -49.05 -47.2 45.01 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.437 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.5 p -62.33 -9.31 7.74 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.407 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 4.7 m-85 -100.16 137.27 38.83 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.602 0.239 . . . . 0.0 110.504 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.462 ' C ' HD11 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -123.17 -96.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.708 -0.223 . . . . 0.0 111.555 -179.591 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.924 ' HA ' HD21 ' A' ' 97' ' ' LEU . 4.2 m -142.97 -34.03 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 111.311 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -83.27 -20.47 34.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.257 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.414 ' O ' ' CB ' ' A' ' 100' ' ' GLN . 8.7 mm-40 -83.34 -38.19 22.39 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.924 HD21 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -73.3 -46.28 50.51 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.355 -179.392 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.595 ' H ' HD22 ' A' ' 97' ' ' LEU . 3.1 ttmt -60.86 -37.29 81.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.885 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.28 -24.22 27.82 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 121' ' ' PHE . 61.6 tt0 -86.82 -43.7 12.29 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.202 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 1.057 HD22 HG21 ' A' ' 106' ' ' ILE . 2.8 mt -55.7 -47.48 76.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.151 0.501 . . . . 0.0 110.121 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -42.06 98.25 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.246 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.43 -8.15 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.041 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.72 -15.32 18.54 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.9 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.75 51.36 2.88 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.972 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 1.057 HG21 HD22 ' A' ' 101' ' ' LEU . 0.9 OUTLIER -133.43 88.6 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.925 0.393 . . . . 0.0 111.022 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 156.27 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.091 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.814 ' HB3' ' HB3' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -142.76 -105.74 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.829 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.11 33.05 1.01 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.735 0.302 . . . . 0.0 111.556 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.86 -35.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.238 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 11.2 t -111.82 -32.17 6.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.08 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.814 ' HB3' ' HB3' ' A' ' 108' ' ' PHE . . . -114.09 119.81 38.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.903 0.382 . . . . 0.0 111.262 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -112.9 -55.58 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.597 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.531 ' HD3' HG12 ' A' ' 94' ' ' VAL . 0.0 OUTLIER -166.25 -39.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.629 179.549 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.11 -22.27 33.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.939 0.399 . . . . 0.0 110.632 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.677 ' O ' HD13 ' A' ' 120' ' ' LEU . 2.1 mt-10 -85.96 -38.11 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.954 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -80.65 -21.18 41.64 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.342 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.954 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -84.52 -28.36 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.933 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.03 -34.1 19.32 Favored 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.385 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.677 HD13 ' O ' ' A' ' 116' ' ' GLU . 2.0 mp -55.4 -34.1 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.402 -179.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.543 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 8.8 m-85 -70.69 -29.35 65.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.73 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.906 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . . . -51.26 -61.24 4.31 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.821 -0.172 . . . . 0.0 111.255 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.906 ' HD3' ' HB3' ' A' ' 122' ' ' ALA . 71.9 Cg_exo -47.92 175.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.46 2.107 . . . . 0.0 112.371 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -129.69 -62.38 0.97 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.126 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -56.79 148.93 19.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.037 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -157.05 59.35 0.35 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.483 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.67 115.75 30.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.77 0.319 . . . . 0.0 110.987 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -139.2 37.76 2.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.954 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.24 101.62 8.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.894 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -74.81 -65.21 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.947 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.276 -0.869 . . . . 0.0 111.13 -179.978 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -31.89 73.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -152.06 59.1 0.85 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.745 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.2 ttp -83.05 111.24 18.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.128 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.61 141.59 45.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.87 22.39 1.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.639 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.76 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 13.6 t -126.58 129.6 48.87 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.048 0.451 . . . . 0.0 110.732 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -147.58 146.79 29.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.323 -179.575 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -89.04 124.65 34.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.676 HG22 ' O ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -110.37 153.6 12.1 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-O 121.322 0.582 . . . . 0.0 112.255 -178.06 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 3.2 p -138.68 123.73 22.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.197 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.892 ' CG1' HD13 ' A' ' 45' ' ' LEU . 35.6 m -93.37 108.87 21.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.966 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.408 ' O ' HG22 ' A' ' 52' ' ' VAL . 9.8 mt-30 -90.0 106.52 18.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.97 146.47 24.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.104 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -138.01 30.43 2.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.51 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.1 mp -95.95 -53.92 7.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.306 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -175.4 -175.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.203 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -111.75 46.92 1.08 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.923 0.392 . . . . 0.0 110.631 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.61 29.99 0.18 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.745 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -95.85 -35.99 11.28 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 120.874 0.369 . . . . 0.0 110.075 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.528 ' HA ' ' HA ' ' A' ' 27' ' ' PHE . 0.2 OUTLIER 57.75 -176.72 0.07 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.274 0.559 . . . . 0.0 112.264 177.595 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.81 -165.59 0.32 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.793 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.43 72.23 9.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.914 0.387 . . . . 0.0 111.202 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.84 13.16 60.99 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.8 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -107.48 -55.32 2.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.994 0.426 . . . . 0.0 110.744 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 t -114.83 148.83 37.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.825 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.528 ' HA ' ' HA ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -163.74 30.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.667 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 173.99 -171.64 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.394 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.546 HD13 ' C ' ' A' ' 29' ' ' LEU . 3.4 tm? -96.6 105.69 17.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.994 0.426 . . . . 0.0 110.407 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 160.44 -138.66 5.64 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.147 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.457 ' HB2' HG22 ' A' ' 11' ' ' VAL . 2.7 p30 -143.3 143.68 31.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 3.0 m-80 -122.41 145.75 47.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.052 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -87.31 145.31 26.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.469 0.652 . . . . 0.0 111.906 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.925 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.6 OUTLIER -114.28 139.41 49.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.641 179.526 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.925 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -71.28 155.26 40.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.089 0.471 . . . . 0.0 110.612 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.76 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -71.23 114.37 9.23 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.327 0.584 . . . . 0.0 112.013 -178.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.689 HG22 ' HG3' ' A' ' 41' ' ' GLN . 0.8 OUTLIER -126.09 -171.66 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.232 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.676 ' N ' HG23 ' A' ' 37' ' ' VAL . 2.0 m -89.97 57.59 3.87 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' A' ' 41' ' ' GLN . 2.9 tt0 78.51 -16.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.413 ' HB3' HG21 ' A' ' 37' ' ' VAL . 0.3 OUTLIER -52.91 -21.51 4.39 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.344 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.689 ' HG3' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -79.96 -28.3 39.61 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.088 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HA ' HG21 ' A' ' 53' ' ' VAL . 3.5 tp -83.51 -31.78 26.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.018 0.437 . . . . 0.0 110.901 -179.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.66 -29.07 22.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.02 -40.35 82.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.121 0.486 . . . . 0.0 109.986 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.983 HD12 HG23 ' A' ' 53' ' ' VAL . 49.0 mt -78.82 -39.58 35.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.782 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.25 -28.04 67.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.031 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.32 -29.88 25.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.337 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.82 118.15 47.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.784 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -85.35 42.67 1.11 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.764 2.309 . . . . 0.0 112.765 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mtp85 -119.79 -38.78 2.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.741 0.305 . . . . 0.0 110.625 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.641 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -101.46 -179.11 3.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.179 179.233 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 13' ' ' GLN . 4.7 m -117.99 137.4 52.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.695 0.283 . . . . 0.0 111.626 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.983 HG23 HD12 ' A' ' 45' ' ' LEU . 4.0 p -125.96 113.1 32.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.094 0.474 . . . . 0.0 110.962 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.676 ' O ' HG22 ' A' ' 10' ' ' VAL . 1.8 mt-30 -127.66 135.57 50.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.325 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.533 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.5 pp -88.56 113.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.491 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.47 104.58 9.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.674 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -120.62 94.25 4.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.836 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.03 33.73 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 170.95 157.71 13.47 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.549 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.6 m -110.01 133.81 52.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.869 0.366 . . . . 0.0 110.963 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -152.07 152.9 32.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.874 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.76 -62.27 0.97 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.9 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 113.33 59.16 0.41 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.55 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 172.97 90.96 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.659 -0.782 . . . . 0.0 112.464 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 60.36 33.65 20.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.826 0.346 . . . . 0.0 110.99 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.95 -139.47 10.44 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.518 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.54 98.05 4.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.77 0.319 . . . . 0.0 110.879 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.9 m -125.65 107.81 10.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.026 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -162.61 58.32 0.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.785 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.437 ' N ' ' HD2' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -179.63 -61.56 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.004 -179.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.437 ' HD2' ' N ' ' A' ' 70' ' ' GLU . 30.7 Cg_endo -63.62 -175.31 0.26 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.478 2.119 . . . . 0.0 112.351 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 62.3 75.76 0.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.014 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 146.53 -46.39 0.75 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.492 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.71 -177.68 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.876 0.37 . . . . 0.0 110.896 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -92.83 164.32 13.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.921 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.2 138.63 50.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -153.75 173.68 15.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.893 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.3 pttt -64.72 -179.1 0.47 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.906 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 -59.96 121.55 12.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.83 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.53 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -171.03 144.45 2.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.838 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.53 ' H ' HD13 ' A' ' 80' ' ' LEU . 18.5 mmm-85 61.8 43.34 9.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.93 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.19 167.06 19.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.042 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.421 ' N ' ' CD ' ' A' ' 84' ' ' PRO . 0.8 OUTLIER -86.78 -52.22 0.43 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.904 -179.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.424 ' HB3' ' CB ' ' A' ' 88' ' ' ASP . 25.9 Cg_exo -62.36 109.71 0.91 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.54 2.16 . . . . 0.0 112.295 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.34 141.67 23.14 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.521 2.147 . . . . 0.0 112.365 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t 58.56 49.93 9.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.919 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.5 p 58.65 160.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.989 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.435 ' O ' ' CE1' ' A' ' 92' ' ' PHE . 0.3 OUTLIER 179.89 -38.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 23.8 tp -107.69 -48.28 3.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.092 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -48.95 -42.77 38.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.464 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 35.3 m -61.89 -15.7 44.8 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.435 ' CE1' ' O ' ' A' ' 88' ' ' ASP . 32.4 m-85 -94.16 91.12 6.63 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 120.889 0.376 . . . . 0.0 110.227 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.3 p -65.09 -105.41 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.748 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.797 HG12 ' NZ ' ' A' ' 98' ' ' LYS . 16.1 t -132.56 -56.48 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.876 0.369 . . . . 0.0 111.601 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.42 -19.78 66.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.113 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.17 -21.44 36.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.214 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.1 OUTLIER -74.39 -58.68 3.14 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.797 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.3 ptpt -59.75 -29.83 68.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.667 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.53 -25.71 28.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.077 0.465 . . . . 0.0 111.75 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -86.73 -36.25 18.75 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.668 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.499 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 7.8 mt -58.54 -48.13 81.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.221 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.455 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -67.45 -38.49 84.56 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.965 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.97 -6.7 55.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.185 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.426 ' HG2' HD11 ' A' ' 106' ' ' ILE . 3.4 ttm-85 -102.79 -15.27 16.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.266 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.4 36.99 4.17 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.634 -0.794 . . . . 0.0 112.863 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.435 ' HB ' HD22 ' A' ' 101' ' ' LEU . 3.9 mp -141.56 91.33 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.72 0.295 . . . . 0.0 111.201 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.8 t -59.96 159.59 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.971 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.455 ' HE1' HG23 ' A' ' 102' ' ' THR . 1.8 p90 -150.14 72.82 1.13 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.691 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -66.02 -67.98 0.4 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.083 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -140.6 32.93 1.83 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -111.67 -34.3 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.877 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.632 ' HB1' ' HB3' ' A' ' 117' ' ' LEU . . . -119.84 85.5 2.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.891 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.475 ' O ' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.28 -85.31 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.114 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.731 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -140.44 -37.18 0.46 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.477 ' N ' ' HG2' ' A' ' 114' ' ' LYS . . . -83.18 -23.81 32.74 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 1.9 mt-10 -85.82 -36.88 19.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.357 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.922 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -80.09 -19.64 46.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.93 -179.655 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.922 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.59 -28.13 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.06 -33.56 19.48 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.998 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.514 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 5.6 tp -49.24 -41.03 36.2 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.085 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.499 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 20.9 m-85 -64.67 78.91 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.217 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.945 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . . . -167.1 -62.24 0.01 OUTLIER Pre-proline 0 CA--C 1.531 0.226 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.945 ' HD3' ' HB3' ' A' ' 122' ' ' ALA . 2.8 Cg_exo -76.23 65.16 7.13 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.543 2.162 . . . . 0.0 112.261 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -146.27 153.02 40.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.129 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.6 168.8 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -172.33 -105.68 0.19 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.486 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -172.04 151.63 2.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.883 0.373 . . . . 0.0 110.961 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -105.68 151.11 24.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.846 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 1.4 m -121.47 88.35 2.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.952 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -137.43 131.72 32.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.918 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.094 -179.936 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 112.446 -0.262 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.5 m 61.19 154.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.892 0.377 . . . . 0.0 110.997 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -140.3 -69.62 0.4 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.884 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 5.7 ttt -178.63 -39.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.865 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -59.29 97.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.008 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.3 tttp -139.17 -171.41 3.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.887 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -175.08 139.78 0.49 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.952 -179.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.487 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.05 143.26 30.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.404 0.621 . . . . 0.0 112.493 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.5 p -95.54 121.67 37.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.71 HG23 ' HA ' ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.8 150.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.025 0.441 . . . . 0.0 111.228 -179.005 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.2 p -135.82 124.54 38.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.298 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.567 HG13 ' HG ' ' A' ' 45' ' ' LEU . 11.3 m -93.14 104.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.369 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.36 108.02 19.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.628 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.813 ' ND2' HD13 ' A' ' 16' ' ' ILE . 8.4 t30 -127.24 146.52 50.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.189 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.565 ' HA ' HD21 ' A' ' 29' ' ' LEU . 8.6 mtp180 -131.34 45.23 2.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.645 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.813 HD13 ' ND2' ' A' ' 14' ' ' ASN . 1.7 mp -93.65 -73.1 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.84 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.679 ' HG3' HG22 ' A' ' 16' ' ' ILE . 2.4 mtpm? -156.51 -173.96 4.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.781 0.324 . . . . 0.0 110.903 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -87.24 -31.22 20.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.92 0.39 . . . . 0.0 110.705 179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.11 46.83 1.11 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.299 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.536 ' CD1' HG21 ' A' ' 16' ' ' ILE . 2.1 t80 -91.44 11.37 24.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.735 0.302 . . . . 0.0 111.136 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 59.39 176.03 0.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.151 0.501 . . . . 0.0 111.613 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.404 ' HB2' ' CG ' ' A' ' 27' ' ' PHE . 2.8 tmm_? -177.75 -68.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.445 179.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.1 14.29 27.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.704 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 105.77 31.23 4.27 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.399 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -173.83 166.92 4.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.642 0.258 . . . . 0.0 110.594 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 p -59.14 101.93 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.831 0.348 . . . . 0.0 110.191 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.404 ' CG ' ' HB2' ' A' ' 22' ' ' ARG . 0.2 OUTLIER -83.73 9.28 12.15 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.896 -179.088 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.401 ' O ' ' CE1' ' A' ' 27' ' ' PHE . 45.3 m-70 63.2 168.23 0.14 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.935 0.398 . . . . 0.0 111.229 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.565 HD21 ' HA ' ' A' ' 15' ' ' ARG . 3.5 tm? -97.27 106.73 19.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.797 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 165.68 -150.83 18.91 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.443 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -119.39 133.49 55.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.828 0.347 . . . . 0.0 110.92 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.457 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 8.9 m120 -116.34 124.46 50.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.617 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -87.16 145.62 26.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.464 0.649 . . . . 0.0 111.464 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.966 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -113.41 139.9 48.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.331 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.966 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.29 157.58 37.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.161 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.887 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.46 111.44 5.32 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.761 0.791 . . . . 0.0 111.214 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.542 ' N ' HG22 ' A' ' 7' ' ' THR . 4.5 t -127.6 168.3 20.98 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.461 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.513 ' H ' HG12 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -52.75 -69.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.742 0.306 . . . . 0.0 111.367 179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -156.71 -16.6 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 87.6 p -42.47 -44.52 4.09 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.546 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.72 -47.03 77.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.807 0.337 . . . . 0.0 111.721 -179.606 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.456 ' N ' ' CD ' ' A' ' 41' ' ' GLN . 6.7 tp -49.24 -55.41 12.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.469 -178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.87 -27.9 61.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.18 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -51.77 68.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.662 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.567 ' HG ' HG13 ' A' ' 12' ' ' VAL . 2.9 mm? -78.82 -44.19 23.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.875 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -63.05 -17.71 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.245 179.885 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.77 -67.72 0.25 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.85 0.357 . . . . 0.0 111.56 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.91 133.58 41.04 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.972 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -84.98 48.64 2.38 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.689 2.259 . . . . 0.0 112.566 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.67 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER -111.42 -38.43 4.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.85 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.708 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -112.96 -176.51 2.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.728 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 m -116.34 128.57 73.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.213 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.471 ' HB ' ' HB3' ' A' ' 45' ' ' LEU . 3.3 p -116.09 116.27 51.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.09 120.65 29.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.239 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.71 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -88.36 139.26 17.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.24 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.0 p -122.2 104.47 9.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.611 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -151.1 102.93 2.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.784 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.4 t -51.49 93.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.168 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -165.52 -178.11 38.34 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.486 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.5 m -161.4 165.14 29.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.828 0.347 . . . . 0.0 110.927 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -142.79 55.18 1.4 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.55 130.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.866 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -105.88 75.86 0.23 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.438 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.47 -125.27 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.447 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -104.3 -66.67 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.772 0.32 . . . . 0.0 110.936 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.28 -164.46 19.2 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.44 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 16.1 tp -116.97 -63.57 1.43 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.848 0.356 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 t 60.95 63.95 1.2 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.12 145.13 39.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.889 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -146.74 91.11 5.34 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.807 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -50.95 117.66 3.56 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.561 2.174 . . . . 0.0 112.403 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.61 128.27 56.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.115 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -131.69 -78.47 0.16 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.51 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.04 152.03 24.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.821 0.343 . . . . 0.0 110.884 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -105.7 -39.46 6.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.913 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.07 151.42 36.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.865 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.94 -39.93 2.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.111 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.12 -19.17 62.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.315 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 61.59 81.63 0.19 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.871 0.367 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -93.67 -35.8 12.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.867 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.18 159.27 44.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.927 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -98.77 146.22 26.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.031 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.63 136.13 95.98 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.912 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.67 149.85 34.57 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.5 2.133 . . . . 0.0 112.358 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -74.21 -168.26 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.481 2.121 . . . . 0.0 112.347 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.2 p 62.06 118.46 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.001 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -127.8 -176.21 3.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.844 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -159.0 -51.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.933 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.645 HD12 ' O ' ' A' ' 118' ' ' ILE . 2.5 mm? -95.63 -24.99 16.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.105 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -49.02 -45.81 43.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.512 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -13.91 31.2 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -106.17 144.8 32.36 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 110.71 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.413 ' O ' HD21 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -98.98 -104.67 0.21 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.974 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.555 ' HA ' HD11 ' A' ' 97' ' ' LEU . 2.9 m -144.86 -38.71 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.763 0.316 . . . . 0.0 111.17 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -82.11 -21.2 36.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.461 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' N ' ' A' ' 100' ' ' GLN . 0.2 OUTLIER -70.28 -52.35 23.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.289 0.566 . . . . 0.0 109.754 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.693 HD22 ' HA ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.81 -57.91 7.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.53 179.185 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.723 ' HE2' HD11 ' A' ' 117' ' ' LEU . 1.8 ttmt -54.3 -36.78 64.05 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.544 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.89 -22.19 29.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.944 0.402 . . . . 0.0 112.001 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.457 ' HB3' ' CE2' ' A' ' 121' ' ' PHE . 0.1 OUTLIER -87.0 -39.1 15.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.275 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.572 HD23 ' CZ ' ' A' ' 121' ' ' PHE . 1.4 mt -59.68 -47.67 84.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.165 0.507 . . . . 0.0 110.034 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.554 HG23 ' HE1' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -64.33 -40.03 95.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.35 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.49 -6.56 53.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.289 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -100.18 -15.24 18.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.158 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.3 28.86 9.36 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.481 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.0 mt -121.95 88.43 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.762 0.315 . . . . 0.0 111.038 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 72.8 p -58.46 140.38 54.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.944 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.554 ' HE1' HG23 ' A' ' 102' ' ' THR . 15.5 p90 -138.78 74.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.24 -71.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -122.27 28.04 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.878 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.07 -31.79 6.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.922 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.546 ' HB3' ' HB2' ' A' ' 108' ' ' PHE . . . -134.51 107.31 7.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.162 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -79.89 -80.15 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.072 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.641 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -141.74 -37.91 0.4 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.797 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.59 -21.16 38.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.877 0.37 . . . . 0.0 110.563 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 46.7 mm-40 -85.74 -38.85 17.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.705 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.735 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -79.89 -19.34 48.41 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.486 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.807 HD13 ' O ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -83.25 -27.73 7.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.823 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.78 -33.13 18.76 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.988 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.525 HD23 HD11 ' A' ' 101' ' ' LEU . 18.1 tp -49.05 -44.15 41.49 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.306 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.572 ' CZ ' HD23 ' A' ' 101' ' ' LEU . 96.2 m-85 -68.26 70.77 0.17 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.296 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.986 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . . . -162.48 -64.01 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.986 ' HD3' ' HB3' ' A' ' 122' ' ' ALA . 16.7 Cg_exo -67.66 101.89 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.258 1.972 . . . . 0.0 112.126 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.88 85.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.009 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -150.16 -178.0 6.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.879 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -155.87 -141.24 3.16 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.547 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -116.05 -42.46 3.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.841 0.353 . . . . 0.0 110.884 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.61 -45.21 0.98 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.93 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.08 142.16 31.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.955 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -141.04 162.72 34.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.889 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.106 180.0 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.9 t 63.5 125.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.777 0.322 . . . . 0.0 110.977 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 -95.4 -67.51 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -178.27 -68.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.849 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -165.87 150.46 8.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.881 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.84 31.58 4.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.793 ' OG1' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -166.73 130.79 2.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.884 -179.986 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.535 ' CE2' HD13 ' A' ' 55' ' ' ILE . 0.2 OUTLIER -146.4 121.81 10.32 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.417 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.2 p -111.35 127.73 55.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 177.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 1.002 HG23 HG22 ' A' ' 55' ' ' ILE . 0.4 OUTLIER -109.84 153.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.08 0.467 . . . . 0.0 111.613 -178.553 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.7 p -138.03 106.54 3.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.849 HG21 HD22 ' A' ' 45' ' ' LEU . 82.2 t -92.48 134.12 31.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.937 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.401 ' CG ' ' HB3' ' A' ' 31' ' ' ASP . 1.1 mt-30 -119.71 108.47 14.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.134 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.35 145.8 26.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.393 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.1 ttp-105 -131.48 34.98 3.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.913 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -104.58 -54.39 6.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.085 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -178.08 -174.12 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.846 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -97.84 27.5 4.42 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.864 0.364 . . . . 0.0 110.887 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.16 53.27 0.28 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.115 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.588 ' CD2' HD21 ' A' ' 51' ' ' LEU . 42.3 t80 -98.25 33.39 2.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.959 0.409 . . . . 0.0 111.052 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? 62.91 -169.62 0.19 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.609 178.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.533 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.2 OUTLIER 66.63 -173.96 0.19 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.633 179.687 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.751 ' HB2' ' CD2' ' A' ' 27' ' ' PHE . . . 75.41 2.42 3.83 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.739 -178.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.39 15.27 69.25 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.396 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.479 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -179.69 -49.17 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.667 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 p 168.9 93.71 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.802 0.334 . . . . 0.0 110.658 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.751 ' CD2' ' HB2' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -61.21 139.25 58.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.971 -179.861 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -86.62 -172.0 3.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.956 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.498 HD13 ' C ' ' A' ' 29' ' ' LEU . 2.7 tm? -99.49 107.65 19.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.659 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 156.29 -142.21 8.6 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.381 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.404 ' HA ' ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -129.04 130.66 46.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 4.1 t-20 -122.87 128.02 49.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.589 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 61.4 m -87.26 145.44 26.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.131 0.491 . . . . 0.0 111.506 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.847 HD13 ' O ' ' A' ' 35' ' ' ALA . 2.7 tm? -102.9 153.73 19.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.674 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.847 ' O ' HD13 ' A' ' 34' ' ' LEU . . . -71.18 157.85 37.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 121.601 0.715 . . . . 0.0 112.805 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.793 ' HB1' ' OG1' ' A' ' 7' ' ' THR . . . -70.69 104.85 2.97 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.551 0.691 . . . . 0.0 110.843 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.643 HG12 ' H ' ' A' ' 38' ' ' SER . 1.1 t -115.43 -159.45 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.947 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.643 ' H ' HG12 ' A' ' 37' ' ' VAL . 4.9 m -107.74 40.82 1.64 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.725 0.297 . . . . 0.0 111.069 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.45 ' CB ' ' O ' ' A' ' 38' ' ' SER . 3.3 tt0 85.75 -18.58 0.35 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.226 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.0 m -50.44 -34.02 23.13 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.121 0.486 . . . . 0.0 110.323 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.49 ' NE2' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.32 -44.81 76.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.383 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.455 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -57.24 -55.48 34.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.871 -179.415 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -70.53 -27.13 63.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -56.87 -51.04 70.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.849 HD22 HG21 ' A' ' 12' ' ' VAL . 0.5 OUTLIER -78.71 -52.96 7.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.665 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.537 ' CA ' HG11 ' A' ' 53' ' ' VAL . 0.3 OUTLIER -53.88 -24.25 15.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.232 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.54 -29.71 1.91 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.437 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -117.85 117.79 35.31 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.763 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.05 68.44 5.8 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.455 2.104 . . . . 0.0 112.27 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mmt-85 -128.26 -43.82 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.101 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.588 HD21 ' CD2' ' A' ' 20' ' ' TYR . 56.6 mt -124.72 142.58 51.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.982 0.42 . . . . 0.0 111.143 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.29 111.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.348 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.537 HG11 ' CA ' ' A' ' 46' ' ' LYS . 1.4 p -98.56 118.19 44.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.127 0.489 . . . . 0.0 110.323 179.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.77 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -121.9 144.79 48.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.397 -179.219 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.002 HG22 HG23 ' A' ' 10' ' ' VAL . 1.8 pp -107.41 144.76 15.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.231 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 m -122.22 104.58 9.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.602 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -97.91 89.92 4.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.878 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.6 p -56.58 99.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.047 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 173.01 -41.55 0.16 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.475 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.3 m -147.75 95.6 2.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.786 0.326 . . . . 0.0 110.911 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.85 132.12 47.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.915 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -146.88 143.48 28.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.939 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -84.74 -151.8 14.86 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.562 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -175.22 -116.49 0.45 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.475 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -162.86 -176.16 4.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.816 0.341 . . . . 0.0 110.979 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -81.17 -147.55 5.6 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.469 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.69 179.92 3.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.832 0.348 . . . . 0.0 110.915 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 3.6 p -163.83 108.92 1.04 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.9 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.5 ptmt -125.79 79.65 1.84 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.99 146.74 33.12 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.892 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.62 150.8 51.58 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.543 2.162 . . . . 0.0 112.295 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -91.13 130.74 36.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.102 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 111.21 163.64 18.03 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.527 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.1 p -116.54 117.67 30.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.912 0.387 . . . . 0.0 110.922 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -122.52 135.75 54.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.931 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -105.64 -31.61 8.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.929 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -68.22 -38.62 82.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.884 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.48 -178.41 4.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -116.13 177.32 4.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.953 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -141.4 74.02 1.44 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.82 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -109.74 -25.4 10.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.04 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 65.27 84.92 0.15 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.062 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -146.1 113.51 4.52 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.762 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.483 ' N ' ' CD ' ' A' ' 85' ' ' PRO . 48.0 Cg_exo -54.76 -45.19 42.83 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.458 2.106 . . . . 0.0 112.499 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 84' ' ' PRO . 36.2 Cg_exo -57.52 85.81 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.368 2.045 . . . . 0.0 112.129 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.43 112.16 19.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.004 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 30.0 m -82.94 -45.32 14.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.837 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 t70 70.53 -63.3 0.41 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.052 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 92' ' ' PHE . 47.6 tp -58.04 -19.53 32.18 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.52 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -49.04 -50.23 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.663 0.268 . . . . 0.0 111.408 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -1.3 9.82 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.505 ' HB2' HD12 ' A' ' 89' ' ' LEU . 2.4 m-85 -95.06 104.68 16.56 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.815 ' O ' HD21 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -123.79 -92.41 0.53 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.965 HG12 ' HZ1' ' A' ' 98' ' ' LYS . 2.0 t -125.5 -50.79 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-O 120.884 0.373 . . . . 0.0 111.773 -179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.34 -19.39 39.41 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.07 -25.97 29.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.828 ' N ' HD13 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -81.77 -53.26 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.509 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.965 ' HZ1' HG12 ' A' ' 94' ' ' VAL . 4.7 ptpt -57.92 -29.74 65.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.116 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.71 -25.47 28.34 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 121' ' ' PHE . 16.2 mt-30 -86.87 -32.83 20.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.459 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 121' ' ' PHE . 9.4 mt -61.14 -48.87 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -38.08 86.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.968 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -75.46 -6.89 52.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.957 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 66.4 mtt-85 -113.72 13.74 18.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.007 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 58.48 60.79 8.28 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.748 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 32.2 mt -144.78 96.38 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.679 0.276 . . . . 0.0 111.18 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.3 p -52.72 149.63 5.97 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.786 0.327 . . . . 0.0 111.105 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -72.66 -50.93 21.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.808 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.14 160.45 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.988 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.15 76.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -178.36 -39.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.656 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HA ' ' HB2' ' A' ' 116' ' ' GLU . . . -82.59 59.31 4.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.007 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.5 -71.9 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.227 -179.806 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.67 ' HA ' HD22 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -153.62 -41.25 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.579 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.85 -22.62 36.88 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.043 0.449 . . . . 0.0 110.199 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 81.6 mm-40 -85.94 -38.07 18.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.62 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.982 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -77.05 -24.07 51.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.335 -179.12 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.982 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.29 -26.57 7.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.182 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.475 ' HB1' ' HB2' ' A' ' 123' ' ' PRO . . . -86.98 -35.16 19.0 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.239 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 116' ' ' GLU . 14.3 tp -50.33 -46.65 55.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.894 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.505 ' CE2' ' HA ' ' A' ' 97' ' ' LEU . 20.5 m-85 -47.81 -70.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.947 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . . . -103.46 -65.86 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.947 ' HD3' ' HB3' ' A' ' 122' ' ' ALA . 85.8 Cg_exo -45.85 154.48 0.69 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.344 2.029 . . . . 0.0 112.786 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -177.18 -177.19 0.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.067 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -102.78 39.7 1.49 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.831 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -93.14 155.01 22.14 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.452 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -171.25 36.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 110.937 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -176.34 149.49 0.84 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.912 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 1.3 m -136.4 31.38 2.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.912 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -149.94 163.34 38.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.846 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.095 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.474 -0.25 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.2 t -142.38 86.46 1.96 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.74 0.305 . . . . 0.0 110.925 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -131.37 -32.05 1.58 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.421 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.5 tpt 74.82 153.16 0.14 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.9 0.381 . . . . 0.0 110.754 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -88.14 -176.44 5.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.234 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.69 -40.19 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.628 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.895 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -114.26 141.45 47.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.392 179.714 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.484 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.01 145.91 31.7 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.276 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 16.9 p -96.18 126.43 41.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.685 HG11 HD12 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -109.89 150.68 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.109 0.481 . . . . 0.0 111.369 -178.872 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 4.4 p -136.98 131.14 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.682 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.001 HG13 HD13 ' A' ' 45' ' ' LEU . 6.7 m -98.39 104.59 16.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.436 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 0.1 OUTLIER -104.6 106.71 17.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.814 179.854 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.754 HD21 HG13 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -130.27 146.48 51.88 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.086 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.47 84.42 2.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.145 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.3 mt -126.3 -61.71 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.762 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -142.34 -83.08 0.19 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.517 0.199 . . . . 0.0 111.218 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 162.88 -16.97 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.915 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.78 46.44 1.08 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.835 -0.697 . . . . 0.0 111.944 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.456 ' HB3' HD11 ' A' ' 29' ' ' LEU . 2.9 t80 -101.66 27.6 6.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.914 0.388 . . . . 0.0 111.072 -179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' PHE . 7.2 mmt180 59.85 -177.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.409 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.773 ' NH1' HG11 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -171.23 -82.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.487 179.384 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -93.94 -43.01 8.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.365 0.602 . . . . 0.0 110.581 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 171.45 39.41 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.862 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.493 ' CE1' ' HB2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -165.02 -160.17 0.48 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.315 -0.443 . . . . 0.0 110.215 -179.171 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.45 78.97 1.91 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.725 0.298 . . . . 0.0 111.27 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.493 ' HB2' ' CE1' ' A' ' 25' ' ' PHE . 6.3 t80 -78.73 151.05 32.32 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.578 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.463 ' O ' ' N ' ' A' ' 30' ' ' GLY . 13.1 m170 -92.67 36.73 1.01 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.914 0.388 . . . . 0.0 110.274 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.506 HD23 ' HB3' ' A' ' 14' ' ' ASN . 7.9 mp 47.81 -86.14 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.34 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 28' ' ' HIS . . . 38.07 -136.48 0.92 Allowed Glycine 0 C--N 1.337 0.637 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.924 179.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.45 116.69 13.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.865 0.364 . . . . 0.0 111.043 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.568 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 42.4 t-20 -119.46 127.59 53.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.208 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.97 145.21 26.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.427 0.632 . . . . 0.0 111.576 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.913 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -111.15 141.8 44.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.841 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.913 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.69 156.72 39.12 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 120.998 0.428 . . . . 0.0 110.575 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.895 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.27 114.26 8.24 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.357 0.599 . . . . 0.0 111.32 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.695 HG23 ' N ' ' A' ' 38' ' ' SER . 0.8 OUTLIER -131.82 -170.81 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.936 -179.49 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.695 ' N ' HG23 ' A' ' 37' ' ' VAL . 0.2 OUTLIER -66.67 -71.43 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.215 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -160.57 -18.15 0.05 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.6 p -42.85 -38.3 2.12 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.74 0.305 . . . . 0.0 111.813 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.709 ' HG2' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -58.56 -42.1 87.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.755 -179.735 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.55 HD13 HG23 ' A' ' 55' ' ' ILE . 5.4 tp -71.54 -30.3 65.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.415 -179.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.494 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -89.32 -27.97 20.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.588 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -69.82 -46.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.89 0.376 . . . . 0.0 110.637 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 1.001 HD13 HG13 ' A' ' 12' ' ' VAL . 65.7 mt -78.91 -31.57 45.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.176 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.52 ' HB2' HG11 ' A' ' 53' ' ' VAL . 13.1 tttt -83.29 -15.7 49.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.298 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.494 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -48.51 -39.46 23.35 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.683 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -121.01 142.63 35.13 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.05 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -84.12 50.7 3.15 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.723 2.282 . . . . 0.0 112.522 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.832 ' C ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -97.79 -49.69 4.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.536 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.832 HD13 ' C ' ' A' ' 50' ' ' ARG . 0.1 OUTLIER -125.26 -171.22 2.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.938 179.3 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.754 HG13 HD21 ' A' ' 14' ' ' ASN . 2.6 m -110.71 143.14 21.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 111.927 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.52 HG11 ' HB2' ' A' ' 46' ' ' LYS . 3.2 p -131.43 117.6 36.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.192 178.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.578 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -127.46 135.06 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.068 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.591 HG22 HE22 ' A' ' 41' ' ' GLN . 1.0 OUTLIER -88.63 120.35 37.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.843 179.231 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 70.8 p -122.19 104.6 9.57 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.875 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -69.04 -63.41 1.07 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.885 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.1 p -103.31 132.15 49.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.86 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 170.15 -37.04 0.18 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.542 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.1 p -132.47 137.8 47.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.819 0.342 . . . . 0.0 110.857 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.99 164.29 12.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.889 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.3 177.21 8.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.855 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -143.66 -130.22 2.36 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.5 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -144.76 -88.83 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.459 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.75 -177.18 5.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.779 0.323 . . . . 0.0 110.857 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.534 ' O ' HD22 ' A' ' 67' ' ' LEU . . . -142.46 105.99 0.43 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.533 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.534 HD22 ' O ' ' A' ' 66' ' ' GLY . 3.4 mm? -125.26 30.6 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.797 0.332 . . . . 0.0 110.873 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -142.07 122.83 14.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.836 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp -77.05 99.33 5.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.871 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -173.79 91.56 0.35 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.926 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.9 103.7 0.9 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.528 2.152 . . . . 0.0 112.349 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -132.47 -46.1 0.9 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.102 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -170.3 -155.3 10.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.468 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.1 m 60.71 -178.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 110.892 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -108.11 162.3 14.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.869 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.6 179.72 5.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.834 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.99 96.0 3.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.851 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt 60.44 24.82 14.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.06 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 62.99 127.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.988 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mt -103.81 136.71 42.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -173.02 39.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.823 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -135.11 28.47 3.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.359 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.452 ' CB ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -90.67 -52.33 0.31 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.949 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.452 ' HD3' ' CB ' ' A' ' 83' ' ' ASP . 4.2 Cg_exo -77.16 113.72 3.65 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.849 2.366 . . . . 0.0 112.009 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -51.37 92.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.319 2.013 . . . . 0.0 112.3 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 59.6 p -129.41 157.02 43.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.043 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.6 t -178.81 131.1 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.867 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -150.33 -178.17 6.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.973 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.75 HD11 ' O ' ' A' ' 118' ' ' ILE . 18.6 tp -120.84 -50.74 2.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.881 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -48.84 -30.39 5.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.741 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.9 t -62.05 -13.1 22.85 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.584 ' HB3' HD23 ' A' ' 97' ' ' LEU . 22.1 m-85 -108.06 159.87 16.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.633 0.254 . . . . 0.0 110.738 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.621 HG22 HG23 ' A' ' 94' ' ' VAL . 65.2 m -118.38 -97.86 0.46 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.609 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.726 ' HA ' HD11 ' A' ' 97' ' ' LEU . 21.2 t -139.05 -52.91 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.059 0 CA-C-O 121.198 0.523 . . . . 0.0 111.347 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -72.74 -19.85 61.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.8 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -80.68 -36.41 32.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 120.852 0.358 . . . . 0.0 110.893 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.726 HD11 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -63.32 -58.35 7.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.317 0.58 . . . . 0.0 109.981 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.622 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 3.3 ptpt -55.06 -33.59 62.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.335 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.74 -22.01 29.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.066 0.46 . . . . 0.0 111.443 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.423 ' OE1' ' CE1' ' A' ' 92' ' ' PHE . 10.8 mt-30 -87.09 -36.8 17.93 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.907 HD21 HD12 ' A' ' 120' ' ' LEU . 9.0 mt -59.45 -48.68 80.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.199 0.523 . . . . 0.0 110.148 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -37.52 83.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.596 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.14 -6.57 59.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.265 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 -100.12 -15.22 18.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.169 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.55 -2.89 21.8 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.006 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.472 ' HB ' HD22 ' A' ' 101' ' ' LEU . 2.9 mt -109.93 78.38 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.909 0.385 . . . . 0.0 111.113 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.445 HG23 ' O ' ' A' ' 107' ' ' THR . 3.5 t -82.17 90.99 6.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.501 ' HE2' HD12 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.04 -177.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.107 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 9.9 mttm -148.46 -51.08 0.17 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.58 30.25 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.894 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -116.72 -37.48 3.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.798 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.497 ' HB3' ' HD2' ' A' ' 108' ' ' PHE . . . -100.99 99.86 10.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.886 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -80.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.241 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.677 ' HA ' HD22 ' A' ' 117' ' ' LEU . 8.3 ptmt -143.01 -38.9 0.34 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.734 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.05 -23.13 38.77 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -85.81 -36.86 19.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.755 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.953 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.0 -22.67 39.24 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.371 -179.419 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.953 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -84.41 -28.14 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.073 178.644 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.61 -33.17 18.94 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 121.209 0.528 . . . . 0.0 110.826 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.907 HD12 HD21 ' A' ' 101' ' ' LEU . 1.4 tm? -49.12 -51.21 33.32 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.692 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.538 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 40.8 m-85 -58.1 82.61 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.703 0.287 . . . . 0.0 110.982 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -148.35 160.31 37.06 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.233 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.68 -42.32 69.57 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.609 2.206 . . . . 0.0 112.157 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -172.47 112.07 0.26 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.203 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -107.18 32.94 4.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.965 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 83.23 -158.51 36.21 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.451 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 60.73 87.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.868 0.366 . . . . 0.0 110.784 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -95.52 74.4 3.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.022 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 3.1 m -111.06 178.0 4.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.795 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 59.58 30.16 19.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.949 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.254 -0.879 . . . . 0.0 111.034 179.932 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.4 t 60.72 36.53 19.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.846 0.355 . . . . 0.0 110.89 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -105.22 -178.01 3.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.961 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.15 -73.3 0.66 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.937 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.94 178.7 5.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.959 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.3 102.32 3.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.976 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.78 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -141.92 154.18 44.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.554 179.79 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.532 ' CE2' ' NE2' ' A' ' 41' ' ' GLN . 0.5 OUTLIER -144.79 143.53 30.7 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.569 ' HB3' ' O ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -89.36 125.12 35.0 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.873 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.731 ' CG1' HD12 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -110.31 149.11 13.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.364 0.602 . . . . 0.0 112.011 -178.395 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 7.5 p -138.6 126.67 28.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.452 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.051 HG13 HD13 ' A' ' 45' ' ' LEU . 16.9 m -93.82 104.69 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.549 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.88 106.56 18.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.427 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.594 ' ND2' HD13 ' A' ' 16' ' ' ILE . 1.8 t30 -105.15 146.45 29.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.07 0.462 . . . . 0.0 111.09 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 mtm180 -135.87 32.05 2.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.205 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.842 HG22 ' CG ' ' A' ' 17' ' ' LYS . 5.0 mp -97.92 -58.26 3.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.23 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.842 ' CG ' HG22 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -168.87 -170.1 1.11 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.801 0.334 . . . . 0.0 110.935 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.431 ' HB2' ' CD2' ' A' ' 28' ' ' HIS . 4.7 pt-20 -109.11 -16.05 14.19 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.137 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.5 44.03 1.59 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.131 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.448 ' CD1' ' HD2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -94.0 -1.72 54.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.576 0.226 . . . . 0.0 111.275 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 60.6 -175.46 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.026 0.441 . . . . 0.0 111.29 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.567 ' NH1' HD23 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -173.92 -162.84 0.15 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.616 179.564 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.485 ' HB3' ' HE1' ' A' ' 25' ' ' PHE . . . -44.76 -30.03 0.88 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.991 0.424 . . . . 0.0 111.375 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 147.24 39.95 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.314 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.485 ' HE1' ' HB3' ' A' ' 23' ' ' ALA . 4.3 m-85 -135.98 23.84 3.31 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.485 0.18 . . . . 0.0 111.485 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 43.72 61.18 2.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.947 0.404 . . . . 0.0 111.123 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CE2' ' HB2' ' A' ' 14' ' ' ASN . 3.4 t80 -56.97 112.6 1.38 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.159 -179.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.431 ' CD2' ' HB2' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -82.22 -172.33 3.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.774 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.546 HD13 ' C ' ' A' ' 29' ' ' LEU . 2.3 tm? -80.57 102.81 10.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.16 0.505 . . . . 0.0 110.177 179.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.19 -139.88 6.23 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.205 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.495 ' HB2' HG22 ' A' ' 11' ' ' VAL . 37.3 p-10 -143.08 143.93 32.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.921 0.391 . . . . 0.0 111.297 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.8 m-20 -119.16 137.86 53.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.079 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -87.19 145.08 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.359 0.599 . . . . 0.0 111.484 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.894 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -115.07 143.4 45.25 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.93 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.894 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.33 157.38 37.84 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-O 121.179 0.514 . . . . 0.0 111.044 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.78 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -69.56 111.34 5.32 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.686 0.755 . . . . 0.0 111.987 -177.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.726 HG12 ' H ' ' A' ' 38' ' ' SER . 2.3 t -129.93 179.67 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.489 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.726 ' H ' HG12 ' A' ' 37' ' ' VAL . 0.6 OUTLIER -104.79 72.61 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -179.127 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.544 ' HA ' ' NE2' ' A' ' 41' ' ' GLN . 0.4 OUTLIER 78.52 -16.65 0.65 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 178.396 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 t -62.58 -21.37 65.56 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.577 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -84.61 -25.77 28.35 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.376 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.539 HD12 HG22 ' A' ' 53' ' ' VAL . 7.5 tp -74.36 -54.72 7.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.96 0.41 . . . . 0.0 110.977 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.63 -21.48 66.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.184 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -48.38 21.61 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 1.051 HD13 HG13 ' A' ' 12' ' ' VAL . 59.1 mt -78.83 -30.75 45.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.284 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.452 ' HB2' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -77.28 -10.26 59.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.373 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.69 -47.94 29.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.794 0.331 . . . . 0.0 111.44 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.5 123.08 64.8 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -80.6 55.28 5.61 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.579 2.186 . . . . 0.0 112.455 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.432 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -135.58 -43.07 0.68 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 -179.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.704 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -90.97 -176.5 4.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.52 108.83 19.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.775 0.321 . . . . 0.0 111.599 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.539 HG22 HD12 ' A' ' 42' ' ' LEU . 1.8 p -98.93 111.77 29.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.195 0.521 . . . . 0.0 110.295 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.629 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.7 mt-30 -127.04 144.66 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.295 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.492 HG22 HG23 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -100.03 133.13 44.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.353 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.9 m -122.4 104.66 9.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.782 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -91.86 -64.73 1.08 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.3 m -67.69 -55.87 11.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.95 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 131.72 93.55 0.59 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.1 t -91.21 161.27 15.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.77 0.319 . . . . 0.0 110.967 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -150.7 -46.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.898 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -158.73 179.86 8.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.858 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -149.3 -68.87 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.523 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.56 27.97 71.76 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.535 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.88 79.28 0.47 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.855 0.359 . . . . 0.0 110.899 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.18 159.22 32.29 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.467 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.52 -31.58 72.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 110.914 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.45 87.77 0.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.962 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -128.84 6.75 5.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.415 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 59.82 159.5 0.1 Allowed Pre-proline 0 C--N 1.332 -0.162 0 CA-C-O 120.792 0.329 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.95 125.76 19.79 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.568 2.179 . . . . 0.0 112.285 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -168.0 -48.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.106 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -103.27 76.15 0.29 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.482 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.7 m -96.72 42.91 1.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.78 0.324 . . . . 0.0 110.861 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.39 103.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.825 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.5 109.24 10.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.879 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -111.05 126.17 54.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.931 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -155.07 82.98 1.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -86.84 104.79 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.023 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.57 ' O ' HD12 ' A' ' 80' ' ' LEU . 3.0 pp -176.33 126.45 0.19 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -99.26 152.66 19.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.927 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.79 157.3 19.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.121 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.412 ' CB ' ' CD ' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -178.51 -61.54 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.886 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.412 ' CD ' ' CB ' ' A' ' 83' ' ' ASP . 59.6 Cg_endo -72.45 109.97 2.87 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.528 2.152 . . . . 0.0 112.347 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.16 174.76 8.52 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.427 2.085 . . . . 0.0 112.309 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.2 m -155.61 126.82 7.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.937 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.61 -71.81 0.2 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.901 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -174.07 -49.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.964 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER -116.86 -33.94 4.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.971 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -48.82 -41.79 34.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.341 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.87 -13.78 27.68 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.439 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 6.2 m-85 -106.29 104.53 14.25 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 66.5 p -89.44 -85.54 0.2 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.997 -178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.712 ' HA ' HD22 ' A' ' 97' ' ' LEU . 24.2 t -145.5 -56.52 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.957 0.408 . . . . 0.0 111.309 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -73.44 -19.25 61.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.005 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -81.99 -20.8 37.76 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.734 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.712 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -78.5 -58.27 3.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.656 ' NZ ' HG12 ' A' ' 94' ' ' VAL . 2.4 ptpt -55.34 -29.66 58.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.345 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.81 -30.32 24.65 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.064 0.459 . . . . 0.0 112.022 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 121' ' ' PHE . 3.9 mm-40 -86.5 -22.02 26.64 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.696 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.796 HD13 ' CD1' ' A' ' 106' ' ' ILE . 1.2 mt -76.87 -42.2 40.81 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.333 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.405 ' HA ' ' CG2' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -64.29 -43.39 94.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.377 179.686 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -6.33 53.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.176 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.469 ' O ' ' HG2' ' A' ' 104' ' ' ARG . 0.7 OUTLIER -108.56 -15.46 14.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.153 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.669 ' O ' HG22 ' A' ' 106' ' ' ILE . . . 144.25 -54.6 0.57 Allowed Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.179 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.951 HD11 ' CD2' ' A' ' 108' ' ' PHE . 9.4 tp 52.27 136.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-O 121.457 0.646 . . . . 0.0 112.725 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 18.1 p -156.36 26.68 0.35 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.545 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.951 ' CD2' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.82 87.52 0.14 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.644 -179.535 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -67.14 70.9 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 51.28 27.3 3.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.6 p -117.43 -29.23 5.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.268 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.752 ' HB3' ' CB ' ' A' ' 108' ' ' PHE . . . -85.22 76.05 10.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.81 0.338 . . . . 0.0 111.386 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -70.59 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.983 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.795 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.1 mttp -154.09 -42.24 0.09 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.73 0.3 . . . . 0.0 111.477 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.29 -23.9 40.39 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.926 0.393 . . . . 0.0 110.143 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 112' ' ' ALA . 3.8 mt-10 -85.97 -37.37 19.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.452 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.88 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.2 OUTLIER -77.88 -19.82 54.1 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.913 -179.624 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.88 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -82.85 -27.85 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.997 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.3 -34.74 18.77 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.84 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.461 ' O ' ' N ' ' A' ' 122' ' ' ALA . 1.2 tp -49.9 -40.43 42.97 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.447 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.526 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 6.0 m-85 -51.58 86.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.287 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 120' ' ' LEU . . . -117.25 140.22 26.95 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.132 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.41 121.81 10.13 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.416 2.077 . . . . 0.0 112.352 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -120.03 -62.8 1.44 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.105 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -85.09 176.97 8.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.901 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -66.25 -168.58 2.85 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.536 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -102.5 149.61 24.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.74 0.305 . . . . 0.0 110.926 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.55 136.65 32.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.997 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 12.1 t -131.96 -47.08 0.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -126.69 -56.68 1.37 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.859 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.211 -0.899 . . . . 0.0 111.096 179.967 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m 60.45 -176.31 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.886 0.374 . . . . 0.0 110.881 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -142.5 127.72 18.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.956 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.1 ptt? -101.8 31.6 3.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.851 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -163.6 -173.72 3.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.829 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.27 40.56 17.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.842 HG22 ' C ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -162.51 132.05 4.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.646 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.504 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.23 144.67 30.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.366 0.603 . . . . 0.0 112.619 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.69 130.06 36.02 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.638 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.737 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.24 152.61 12.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.265 0.555 . . . . 0.0 112.079 -178.557 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.5 p -138.47 102.1 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.316 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.847 HG21 HD13 ' A' ' 45' ' ' LEU . 42.9 t -92.49 130.25 41.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.18 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 30' ' ' GLY . 28.3 tt0 -125.0 106.62 10.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.866 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -96.64 146.57 24.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.694 179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.488 ' H ' HD12 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -124.74 38.4 4.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.234 0.54 . . . . 0.0 110.142 179.151 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.69 ' N ' HD21 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -146.83 139.41 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.315 -179.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.863 ' O ' HD23 ' A' ' 29' ' ' LEU . 0.0 OUTLIER 50.43 -163.86 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.135 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -96.44 63.63 2.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.557 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.424 ' HA3' ' C ' ' A' ' 27' ' ' PHE . . . 93.84 -34.82 4.44 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.027 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 77.48 39.97 0.17 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.821 0.343 . . . . 0.0 111.004 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 60.24 -175.84 0.11 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.434 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.441 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -172.88 -162.65 0.18 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.822 179.566 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.27 -19.3 13.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.47 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 150.08 -12.56 0.95 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.567 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -77.09 -6.04 51.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.658 0.266 . . . . 0.0 111.198 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.41 ' O ' ' CE1' ' A' ' 28' ' ' HIS . 0.6 OUTLIER 62.49 73.81 0.45 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.039 0.447 . . . . 0.0 110.845 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.441 ' HB2' ' HB2' ' A' ' 22' ' ' ARG . 4.4 t80 -55.94 157.45 4.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.594 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.41 ' CE1' ' O ' ' A' ' 26' ' ' SER . 65.4 m80 -129.63 167.62 17.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.814 0.34 . . . . 0.0 110.977 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.863 HD23 ' O ' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -67.55 103.57 1.38 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.252 0.549 . . . . 0.0 110.477 179.252 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.436 ' O ' ' HA ' ' A' ' 13' ' ' GLN . . . 170.76 -140.51 6.01 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.108 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -138.9 131.63 29.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.768 0.318 . . . . 0.0 111.02 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.43 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 10.1 m-20 -126.38 131.78 51.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.236 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.4 m -87.22 145.76 26.26 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.167 0.508 . . . . 0.0 111.162 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.946 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -115.34 141.16 48.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.118 -179.847 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.946 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.67 157.3 38.23 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.9 0.381 . . . . 0.0 110.219 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.842 ' C ' HG22 ' A' ' 7' ' ' THR . . . -69.2 114.58 7.59 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.742 0.782 . . . . 0.0 111.352 -177.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 38' ' ' SER . 11.1 t -127.79 167.91 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.775 -179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.542 ' N ' HG12 ' A' ' 37' ' ' VAL . 0.3 OUTLIER -53.39 -53.71 47.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.595 -179.93 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.74 -20.62 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -42.38 -33.1 0.6 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.825 0.345 . . . . 0.0 111.473 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.616 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.1 -57.85 11.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.771 179.618 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.44 HD13 HG23 ' A' ' 55' ' ' ILE . 8.8 tp -53.05 -55.47 23.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.874 -178.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -67.33 -30.94 70.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -53.08 -54.62 32.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.364 . . . . 0.0 110.661 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.847 HD13 HG21 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -79.07 -54.45 5.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.062 179.783 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.652 ' N ' HG11 ' A' ' 53' ' ' VAL . 11.7 tttt -49.26 -25.94 2.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.511 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -45.19 -30.2 1.13 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.541 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -112.5 121.73 38.17 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.774 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -77.19 69.58 7.05 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.468 2.112 . . . . 0.0 112.266 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.35 -40.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.173 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.711 HD22 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -100.22 124.45 45.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.754 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.501 ' O ' HG13 ' A' ' 12' ' ' VAL . 3.5 t -69.7 106.11 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.999 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.652 HG11 ' N ' ' A' ' 46' ' ' LYS . 2.0 p -107.13 117.73 53.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.703 178.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.727 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.07 142.96 51.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.084 -178.665 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.526 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.2 pt -93.8 126.78 46.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.28 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t -122.28 104.59 9.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.59 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.558 ' O ' HG22 ' A' ' 58' ' ' THR . 2.5 pm0 -84.54 -59.64 2.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.574 -179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 57' ' ' GLU . 12.8 t 47.25 -171.26 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.79 0.329 . . . . 0.0 111.298 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -114.12 141.47 17.0 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.667 -0.777 . . . . 0.0 112.57 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.4 m -71.53 95.24 1.38 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.869 0.366 . . . . 0.0 110.927 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -114.01 -37.34 4.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.866 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -92.96 140.26 29.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.89 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -98.01 146.46 18.22 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.493 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -131.52 154.24 20.8 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.517 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -133.46 30.79 3.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.851 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 170.54 171.03 35.51 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.425 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.61 -61.36 1.39 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.801 0.334 . . . . 0.0 110.859 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -175.63 -55.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.04 143.54 23.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -57.88 109.42 1.78 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.988 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.65 135.73 24.44 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.516 2.144 . . . . 0.0 112.312 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.91 -63.81 1.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.069 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -155.05 -162.77 11.49 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.451 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.85 -34.05 34.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.783 0.325 . . . . 0.0 110.87 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -174.8 -41.01 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -156.02 98.56 1.9 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.911 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -140.5 -177.19 4.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.26 175.5 6.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.954 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -107.63 -159.26 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.71 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.6 mt 66.02 41.75 3.53 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.808 0.337 . . . . 0.0 110.969 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.1 mtm-85 62.69 132.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.085 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -98.75 -30.79 12.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.025 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -92.46 112.64 56.39 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.848 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.482 ' N ' ' CD ' ' A' ' 85' ' ' PRO . 44.1 Cg_exo -55.33 -45.08 42.81 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.372 2.048 . . . . 0.0 112.564 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' A' ' 84' ' ' PRO . 47.2 Cg_exo -56.11 123.24 13.35 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.362 2.041 . . . . 0.0 112.188 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 21.3 t -161.97 85.76 0.61 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.935 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.4 m -145.09 87.79 1.85 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 62.04 34.99 16.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.026 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 1.017 HD21 ' HB3' ' A' ' 122' ' ' ALA . 3.0 mm? -110.09 -27.11 9.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.058 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -54.62 -50.28 68.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.332 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.8 m -62.41 -14.63 42.62 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.48 ' HB3' HD11 ' A' ' 118' ' ' ILE . 4.3 m-85 -71.75 -14.45 62.01 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 122.24 -0.287 . . . . 0.0 111.26 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.757 ' O ' HD11 ' A' ' 97' ' ' LEU . 0.2 OUTLIER 57.74 -148.72 0.48 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.968 179.293 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.689 ' O ' HD22 ' A' ' 97' ' ' LEU . 4.0 m -127.44 -32.08 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.166 0.508 . . . . 0.0 110.993 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.6 -19.55 38.18 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.441 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -80.45 -23.6 40.13 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.823 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 1.01 HD13 ' H ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -84.78 -48.92 8.91 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.18 179.8 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HE3' ' CD2' ' A' ' 117' ' ' LEU . 0.8 OUTLIER -57.89 -35.67 71.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.611 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.16 -23.97 28.15 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.501 ' HG2' ' CE1' ' A' ' 121' ' ' PHE . 1.0 OUTLIER -86.52 -37.89 17.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.664 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.795 HD12 ' CD1' ' A' ' 117' ' ' LEU . 1.9 mt -59.34 -46.98 87.13 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.479 HG23 ' CZ ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -59.93 -43.08 95.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.961 179.297 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -72.62 -6.78 46.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.051 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -105.98 -15.43 14.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.87 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 63.05 63.85 4.25 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.725 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.668 ' HB ' HD22 ' A' ' 101' ' ' LEU . 48.5 mm -116.59 -86.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.587 0.194 . . . . 0.0 111.109 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.657 HG22 HG22 ' A' ' 106' ' ' ILE . 1.3 t 169.88 150.13 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.479 ' CZ ' HG23 ' A' ' 102' ' ' THR . 13.4 p90 -171.89 92.27 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.971 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -176.79 135.4 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.883 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 68.84 -67.11 0.22 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.873 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.3 p -65.88 -68.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.71 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.562 ' O ' HG23 ' A' ' 113' ' ' THR . . . -79.98 179.56 7.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.965 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.562 HG23 ' O ' ' A' ' 112' ' ' ALA . 0.1 OUTLIER -172.34 -80.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.749 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.407 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 0.0 OUTLIER -138.21 -57.49 0.65 Allowed 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.422 179.676 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.71 -35.03 79.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.148 0.499 . . . . 0.0 109.954 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -86.84 -33.95 19.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.756 179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.795 ' CD1' HD12 ' A' ' 101' ' ' LEU . 1.7 tp -74.67 -37.47 62.68 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.896 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.703 ' O ' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -77.56 -28.31 15.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.101 179.651 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.75 -32.5 20.37 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 121.077 0.465 . . . . 0.0 110.872 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.7 mt -54.98 -40.36 69.96 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.641 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.56 ' CD2' ' HB3' ' A' ' 97' ' ' LEU . 1.4 m-85 -51.5 -41.08 60.71 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.676 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 1.017 ' HB3' HD21 ' A' ' 89' ' ' LEU . . . -129.78 85.94 56.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.427 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.25 -27.61 7.92 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.599 2.199 . . . . 0.0 112.077 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -169.87 -42.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.956 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.554 ' OD1' ' HB2' ' A' ' 131' ' ' ALA . 0.6 OUTLIER 61.21 44.6 9.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.989 179.816 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 75.04 -171.53 53.86 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.542 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.41 100.03 5.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.829 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.5 tttt 60.87 176.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.869 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 3.0 t 68.93 -67.28 0.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.959 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -101.44 153.51 19.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.907 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.554 ' HB2' ' OD1' ' A' ' 125' ' ' ASP . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.205 -0.903 . . . . 0.0 111.145 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.28 103.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.825 0.345 . . . . 0.0 110.857 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -139.47 -47.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 36.9 mmt -104.95 -30.58 9.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.917 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -79.3 155.77 28.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.099 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -149.65 83.79 1.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.884 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.867 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -139.09 139.49 37.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.785 -179.839 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.493 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -145.07 137.12 25.77 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 17.7 p -87.91 124.41 33.65 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.801 HG12 ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -110.02 157.72 10.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 CA-C-O 120.923 0.392 . . . . 0.0 111.385 -178.625 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 32' ' ' ASN . 1.4 p -138.51 108.97 4.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.112 0.482 . . . . 0.0 110.537 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.961 HG22 HD13 ' A' ' 45' ' ' LEU . 2.5 t -92.68 135.9 26.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.23 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -116.72 113.34 22.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.757 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.522 ' HB3' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -96.59 137.38 35.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.039 0.447 . . . . 0.0 110.951 -179.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -135.72 29.74 3.18 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.215 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.829 HG22 ' HG2' ' A' ' 17' ' ' LYS . 3.3 mp -107.08 -60.05 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.389 -179.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.829 ' HG2' HG22 ' A' ' 16' ' ' ILE . 1.6 mmmm -148.38 -175.49 4.93 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.739 0.304 . . . . 0.0 110.911 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -109.81 0.68 18.9 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.984 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -141.78 44.81 0.98 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.827 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.558 ' O ' ' HG2' ' A' ' 21' ' ' ARG . 4.8 t80 -86.96 56.84 4.19 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.063 0.458 . . . . 0.0 110.264 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 41.58 110.48 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.893 -1.048 . . . . 0.0 112.856 179.074 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.579 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -58.5 -156.06 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.215 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . 79.12 28.93 0.37 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.983 0.421 . . . . 0.0 110.41 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 102.81 34.31 4.1 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.521 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.467 ' HB2' ' O ' ' A' ' 21' ' ' ARG . 56.3 m-85 -155.84 -70.93 0.11 Allowed 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.522 ' HB2' ' C ' ' A' ' 20' ' ' TYR . 38.4 t -54.37 -94.23 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.619 0.247 . . . . 0.0 111.326 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 55.15 26.03 7.86 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.721 0.296 . . . . 0.0 110.954 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.52 176.84 0.14 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.63 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HA ' HD23 ' A' ' 29' ' ' LEU . 15.7 mt -82.35 101.02 10.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.163 0.506 . . . . 0.0 110.831 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 175.05 -141.03 5.58 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.178 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -128.58 127.01 41.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.773 0.321 . . . . 0.0 110.961 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.407 ' O ' ' HA ' ' A' ' 11' ' ' VAL . 7.5 p30 -114.73 123.39 49.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.848 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.9 m -87.44 145.73 26.15 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.331 0.586 . . . . 0.0 111.629 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.951 HD22 ' N ' ' A' ' 35' ' ' ALA . 0.5 OUTLIER -114.91 139.08 50.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.945 179.671 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.951 ' N ' HD22 ' A' ' 34' ' ' LEU . . . -70.8 156.4 39.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.867 ' HB1' ' HB ' ' A' ' 7' ' ' THR . . . -70.63 116.73 11.29 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.415 0.626 . . . . 0.0 111.384 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.66 HG23 ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -130.19 -171.69 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.849 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.66 ' N ' HG23 ' A' ' 37' ' ' VAL . 44.3 p -59.77 -58.63 7.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.172 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 179.88 -16.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.4 t -42.54 -34.76 0.91 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.655 HE22 HG21 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -58.9 -48.75 80.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.843 0.354 . . . . 0.0 111.356 -179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.526 HD13 HG21 ' A' ' 55' ' ' ILE . 9.3 tp -55.55 -50.11 70.91 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.406 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 47' ' ' ALA . . . -77.25 -29.67 54.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.444 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -58.59 -46.57 86.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.119 0.485 . . . . 0.0 110.15 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.961 HD13 HG22 ' A' ' 12' ' ' VAL . 4.5 mt -78.95 -48.15 15.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.704 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.418 ' CA ' HG11 ' A' ' 53' ' ' VAL . 1.5 ttmm -64.12 -16.72 62.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.291 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 43' ' ' ALA . . . -46.53 -41.94 14.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.807 0.337 . . . . 0.0 111.462 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.422 ' HB2' ' CE1' ' A' ' 25' ' ' PHE . 0.6 OUTLIER -101.83 121.37 51.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.84 179.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.54 62.6 6.33 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.57 2.18 . . . . 0.0 112.3 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.78 -46.14 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 14' ' ' ASN . 44.6 mt -92.26 144.49 25.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.993 0.425 . . . . 0.0 111.187 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.69 108.18 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.935 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.623 HG23 HD12 ' A' ' 45' ' ' LEU . 1.3 p -104.66 121.39 56.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.971 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.705 ' O ' HG22 ' A' ' 10' ' ' VAL . 9.0 pm0 -126.92 133.39 50.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.635 -179.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.66 ' HA ' HG23 ' A' ' 10' ' ' VAL . 1.1 pt -97.98 131.33 45.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.446 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.3 m -122.38 104.53 9.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.459 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -84.76 -79.32 0.22 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.104 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.77 113.14 16.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.961 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -107.37 40.09 2.65 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.407 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 26.1 m 61.02 76.21 0.38 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.789 0.328 . . . . 0.0 110.944 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -176.01 116.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.826 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.13 129.99 45.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 92.22 -148.37 19.13 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.53 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -148.91 48.23 0.61 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.466 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -64.08 152.91 39.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.806 0.336 . . . . 0.0 110.905 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 119.27 -56.68 0.57 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.419 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.3 mt -92.8 124.93 37.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 110.906 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.9 p -101.89 157.0 17.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.88 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.94 -49.11 6.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.869 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.25 152.36 84.83 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.912 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.67 128.93 16.82 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.59 2.193 . . . . 0.0 112.327 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -144.46 -57.58 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.101 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 67.04 99.95 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.508 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.72 124.1 20.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.8 0.334 . . . . 0.0 110.921 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -106.34 69.5 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -159.48 107.32 1.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -115.68 161.97 17.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.878 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -157.27 -46.82 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.93 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.95 164.82 11.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.817 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.443 HD23 ' N ' ' A' ' 80' ' ' LEU . 2.3 pt? -158.44 32.34 0.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.926 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.23 70.76 0.1 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.9 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.89 105.46 0.32 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.158 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -161.31 87.8 1.63 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.854 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -51.65 139.32 48.3 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.479 2.119 . . . . 0.0 112.277 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -73.65 157.46 48.4 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.448 2.099 . . . . 0.0 112.321 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.494 ' O ' HG22 ' A' ' 87' ' ' THR . 4.8 p -77.52 141.77 39.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.908 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.494 HG22 ' O ' ' A' ' 86' ' ' SER . 15.0 t 45.41 -167.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.319 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.52 ' O ' HG22 ' A' ' 91' ' ' THR . 0.4 OUTLIER 68.45 -69.0 0.16 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.943 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.473 HD12 HD11 ' A' ' 118' ' ' ILE . 4.1 mm? -63.34 -16.91 61.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.203 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -49.06 -50.29 37.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.393 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.52 HG22 ' O ' ' A' ' 88' ' ' ASP . 1.4 t -62.19 -15.08 44.09 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -114.22 103.5 11.16 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.697 0.284 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.445 ' N ' HD11 ' A' ' 97' ' ' LEU . 0.6 OUTLIER -94.55 -80.87 0.4 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.593 -179.579 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.753 ' HA ' HD22 ' A' ' 97' ' ' LEU . 28.1 t -147.33 -56.58 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.81 0.338 . . . . 0.0 111.302 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.99 -19.59 60.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.981 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 100' ' ' GLN . 0.0 OUTLIER -82.65 -21.28 35.05 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.514 -179.362 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.753 HD22 ' HA ' ' A' ' 94' ' ' VAL . 0.0 OUTLIER -75.6 -58.47 3.26 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -57.12 -29.13 63.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.29 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.9 23.95 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 96' ' ' GLN . 7.3 mm-40 -84.17 -28.01 27.67 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.216 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.944 HD22 ' HA ' ' A' ' 106' ' ' ILE . 1.1 mt -69.78 -45.73 67.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.849 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.489 ' HA ' ' HB ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -57.33 -45.29 84.4 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.373 179.541 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -75.52 -6.32 49.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.413 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -114.76 24.17 12.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.599 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.61 -32.09 6.87 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.743 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.944 ' HA ' HD22 ' A' ' 101' ' ' LEU . 0.5 OUTLIER 43.9 96.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 112.106 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -118.16 28.23 8.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.512 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.917 ' CE2' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -69.34 -177.74 1.21 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.096 -179.79 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.43 165.91 12.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.96 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -26.12 42.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.943 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -82.58 0.89 40.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.387 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.82 77.53 0.08 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.785 0.326 . . . . 0.0 111.005 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 70.5 p -77.05 -79.75 0.11 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.979 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.722 ' HA ' HD22 ' A' ' 117' ' ' LEU . 2.1 pptp? -146.55 -39.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.667 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.412 ' HA ' HG22 ' A' ' 118' ' ' ILE . . . -80.82 -23.75 38.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.94 0.4 . . . . 0.0 110.714 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -85.92 -37.2 19.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.502 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.891 HD23 ' N ' ' A' ' 118' ' ' ILE . 0.1 OUTLIER -81.65 -19.33 41.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.947 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.891 ' N ' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -83.48 -26.27 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.101 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.52 -34.31 20.04 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.819 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.98 -41.57 64.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.077 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.493 ' CE1' ' HG ' ' A' ' 101' ' ' LEU . 4.6 m-85 -48.21 -59.22 3.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.42 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.407 ' HB1' ' HD2' ' A' ' 123' ' ' PRO . . . 61.39 163.42 0.11 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.089 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.407 ' HD2' ' HB1' ' A' ' 122' ' ' ALA . 50.5 Cg_exo -55.59 167.76 1.92 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.596 2.197 . . . . 0.0 112.441 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -169.13 136.99 1.9 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.006 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -107.07 -67.51 0.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.082 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -145.63 -143.94 4.03 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.591 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -125.78 151.68 46.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.819 0.342 . . . . 0.0 110.944 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -168.43 -46.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.823 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.45 -39.05 3.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.875 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.09 107.44 5.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.878 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.132 179.973 . . . . . . . . 0 0 . 1 stop_ save_